Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 5/20 | 0.45 |
| ▸ | CA2 | P00918 | 5/20 | 0.45 |
| ▸ | CA9 | Q16790 | 4/20 | 0.45 |
| ▸ | CA12 | O43570 | 3/20 | 0.45 |
| ▸ | CA5A | P35218 | 2/20 | 0.45 |
| ▸ | CA4 | P22748 | 1/20 | 0.45 |
| ▸ | CA6 | P23280 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11331283 | 0.84 | CA2 (0.49) | KDM4EALDH1A1POLBMEN1CYP1A2 | |
| SCHEMBL1820456 | 0.83 | TSHR (0.55) | KDM4EALDH1A1POLBMEN1CYP3A4 | |
| SCHEMBL30782672 | 0.83 | TSHR (0.55) | KDM4EALDH1A1POLBMEN1CYP3A4 | |
| SCHEMBL4638383 | 0.82 | CA12 (0.59) | KDM4EALDH1A1POLBMEN1NPC1 | |
| SCHEMBL11333441 | 0.82 | CA1 (0.48) | KDM4EALDH1A1POLBMEN1NPC1 | |
| SCHEMBL16261364 | 0.80 | CA1 (0.53) | KDM4EALDH1A1POLBMEN1NPC1 | |
| SCHEMBL11327217 | 0.80 | ALDH1A1 (0.55) | KDM4EALDH1A1POLBMEN1NPC1 | |
| SCHEMBL11505922 | 0.79 | CA1 (0.41) | KDM4EALDH1A1POLBMEN1NPC1 | |
| SCHEMBL11328006 | 0.78 | FFAR4 (0.51) | KDM4EALDH1A1POLBMEN1NPC1 | |
| SCHEMBL11325993 | 0.78 | CA12 (0.43) | KDM4EALDH1A1POLBMEN1NPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4243584-A | Monoazo dyestuffs containing diazo component substituted by disulfimide and trifluoromethyl groups | BAYER AKTIENGESELLSCHAFT (DE) | 1981-01-06 | — | — | US | disclosed |
| US-4159265-A | Phenylazopyrazolo dyestuffs including disulfimide substituent | BAYER AKTIENGESELLSCHAFT (DE) | 1979-06-26 | — | — | US | disclosed |