Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL166973 | 0.88 | DHFR (0.37) | ALDH1A1CYP1A2ALOX15CASP7HIF1A | |
| SCHEMBL10341214 | 0.84 | ALDH1A1 (0.36) | ALDH1A1CYP1A2ALOX15CASP7HIF1A | |
| SCHEMBL169186 | 0.83 | P2RX3 (0.34) | — | |
| SCHEMBL1684035 | 0.76 | ALDH1A1 (0.45) | ALDH1A1CYP1A2ALOX15CASP7HIF1A | |
| SCHEMBL167931 | 0.76 | P2RX3 (0.31) | — | |
| SCHEMBL165542 | 0.76 | DHFR (0.40) | — | |
| SCHEMBL10341255 | 0.73 | ALDH1A1 (0.42) | ALDH1A1CYP1A2ALOX15CASP7HIF1A | |
| SCHEMBL10534780 | 0.73 | TSHR (0.46) | ALDH1A1CYP1A2TP53CYP3A4TSHR | |
| SCHEMBL165193 | 0.72 | ALDH1A1 (0.36) | ALDH1A1CYP1A2ALOX15CASP7HIF1A | |
| SCHEMBL166582 | 0.72 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2638088-A1 | HALOGENATION OF 4,4'-METHYLENE-BIS-ANILINES | Lonza Ltd (CH) | 2013-09-18 | — | — | EP | disclosed |
| WO-2012028323-A1 | HALOGENATION OF 4,4'-METHYLENE-BIS-ANILINES | LONZA LTD (CH) | 2012-03-08 | — | — | WO | disclosed |
| US-4950792-A | CHAIN LENGTHENING, CROSSLINKING AGENT FOR POLYURETHANES | LONZA LTD. (CH) | 1990-08-21 | — | — | US | disclosed |
| EP-0220641-B1 | SUBSTITUTED P,P'-METHYLENE-BIS-ANILINES | LONZA AG (CH) | 1990-02-28 | — | — | EP | disclosed |
| EP-0220641-A1 | Substituted p,p'-methylene-bis-anilines | LONZA AG (CH) | 1987-05-06 | — | — | EP | disclosed |