Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | F2R | P25116 | 9/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | ICMT | O60725 | 1/20 | 0.45 |
| ▸ | ALB | P02768 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11524047 | 0.95 | KDM4E (0.53) | ALDH1A1KDM4EGAAALOX15ICMT | |
| SCHEMBL621847 | 0.95 | ALDH1A1 (0.54) | ALDH1A1MAPK1F2RMTNR1BGAA | |
| SCHEMBL11521271 | 0.94 | ALDH1A1 (0.45) | ALDH1A1MAPK1F2RKDM4EGAA | |
| SCHEMBL11406174 | 0.92 | KDM4E (0.55) | ALDH1A1KDM4EGAAALOX15ICMT | |
| SCHEMBL11521537 | 0.91 | CYP3A4 (0.50) | ALDH1A1MAPK1F2RKDM4EMTNR1B | |
| SCHEMBL11524205 | 0.90 | ALDH1A1 (0.52) | ALDH1A1MAPK1F2RKDM4EMTNR1B | |
| SCHEMBL11524535 | 0.88 | KDM4E (0.53) | ALDH1A1KDM4EGAAALOX15MAPT | |
| SCHEMBL11524665 | 0.87 | POLB (0.48) | ALDH1A1MTNR1BMAPTMTNR1AMEN1 | |
| SCHEMBL30020925 | 0.87 | LMNA (0.54) | ALDH1A1KDM4EICMTALBMEN1 | |
| SCHEMBL30020332 | 0.85 | ICMT (0.56) | ALDH1A1KDM4EICMTALBHPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4139528-A | Water-insoluble monoazo dyestuffs which is a diazotized 6-cyano-2:4-dinitroaniline coupled to a m-acylamino-substituted aniline | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1979-02-13 | — | — | US | disclosed |