Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 5/20 | 0.44 |
| ▸ | CA1 | P00915 | 4/20 | 0.44 |
| ▸ | CA12 | O43570 | 4/20 | 0.44 |
| ▸ | CA9 | Q16790 | 4/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.44 |
| ▸ | CA3 | P07451 | 2/20 | 0.44 |
| ▸ | CA6 | P23280 | 2/20 | 0.44 |
| ▸ | CA5A | P35218 | 2/20 | 0.44 |
| ▸ | CA7 | P43166 | 2/20 | 0.44 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL31006397 | 0.77 | TSHR (0.46) | KMT2AALDH1A1TSHRCA2CA1 | |
| SCHEMBL11842036 | 0.77 | SMN1; SMN2 (0.41) | KMT2AALDH1A1TSHRTP53ALOX15 | |
| Water SCHEMBL10524804 | 0.75 | SMN1; SMN2 (0.39) | KMT2AALDH1A1TSHRTP53ALOX15 | |
| Terephthalic Acid SCHEMBL17210199 | 0.75 | TSHR (0.75) | KMT2AALDH1A1TSHRTP53ALOX15 | |
| SCHEMBL2116518 | 0.73 | MAPT (0.42) | KMT2AALDH1A1TSHRTP53CA2 | |
| Terephthalic Acid SCHEMBL29007040 | 0.73 | TSHR (0.71) | KMT2AALDH1A1TSHRTP53ALOX15 | |
| Terephthalic Acid SCHEMBL28266394 | 0.73 | TSHR (0.71) | KMT2AALDH1A1TSHRTP53ALOX15 | |
| SCHEMBL12697477 | 0.72 | TSHR (0.55) | KMT2AALDH1A1TSHRTP53ALOX15 | |
| SCHEMBL10371035 | 0.71 | TSHR (0.52) | KMT2AALDH1A1TSHRTP53ALOX15 | |
| Terephthalic Acid SCHEMBL28813358 | 0.71 | TSHR (0.67) | KMT2AALDH1A1TSHRTP53ALOX15 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0623119-B1 | NOVEL 3-HALO-5-HALOMETHYL-2-OXAZOLIDINONES AND THEIR USE AS MICROBICIDES | BUCKMAN LABOR INC (US) | 2001-11-28 | — | — | EP | disclosed |
| EP-0827690-B1 | Sulphur-containing quaternary ammonium ionene polymers and their use as microbicides | BUCKMAN LABOR INC (US) | 2000-09-27 | — | — | EP | disclosed |
| EP-0607420-B1 | METHOD FOR THE DETOXIFICATION OF MUSTARD GAS, AND SULFUR-CONTAINING QUATERNARY AMMONIUM IONENE POLYMERS | BUCKMAN LABOR INC (US) | 1998-11-04 | — | — | EP | disclosed |
| EP-0827690-A2 | Sulphur-containing quaternary ammonium ionene polymers and their use as microbicides | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1998-03-11 | — | — | EP | disclosed |
| US-5703131-A | Method for the detoxification of mustard gas sulfur-containing quaternary ammonium ionene polymers and their use as microbicides | BUCKMAN LABORATORIES INTERNATIONAL INC. (US) | 1997-12-30 | — | — | US | disclosed |
| US-5401881-A | Sulfur-containing quaternary ammonium ionene polymers and their use as microbicides | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1995-03-28 | — | — | US | disclosed |
| US-5387717-A | Method for the detoxification of mustard gas, sulfur-containing quaternary ammonium ionene polymers and their use as microbicides | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1995-02-07 | — | — | US | disclosed |
| EP-0623119-A1 | NOVEL 3-HALO-5-HALOMETHYL-2-OXAZOLIDINONES AND THEIR USE AS MICROBICIDES | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1994-11-09 | — | — | EP | disclosed |
| EP-0607420-A1 | METHOD FOR THE DETOXIFICATION OF MUSTARD GAS, SULFUR-CONTAINING QUATERNARY AMMONIUM IONENE POLYMERS AND THEIR USE AS MICROBICIDES | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1994-07-27 | — | — | EP | disclosed |
| WO-1994004225-A2 | METHOD FOR THE DETOXIFICATION OF MUSTARD GAS, SULFUR-CONTAINING QUATERNARY AMMONIUM IONENE POLYMERS AND THEIR USE AS MICROBICIDES | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1994-03-03 | — | — | WO | disclosed |
| WO-1993013081-A1 | NOVEL 3-HALO-5-HALOMETHYL-2-OXAZOLIDINONES AND THEIR USE AS MICROBICIDES | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1993-07-08 | — | — | WO | disclosed |
| US-5162354-A | For controlling growth of microorganisms in aqueous system or surface | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1992-11-10 | — | — | US | disclosed |
| US-4338331-A | DIURETIC, SLLURETIC, HYPOTENSIVE | FARMATIS S.P.A. (IT) | 1982-07-06 | — | — | US | disclosed |