Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6992507 | 0.89 | ALDH1A1 (0.45) | TP53ALDH1A1MAPK1KDM4EHTT | |
| SCHEMBL6999204 | 0.89 | MAPK1 (0.46) | KMT2AGAAALDH1A1MAPK1ACHE | |
| SCHEMBL7956133 | 0.87 | KDM4E (0.43) | KMT2AALDH1A1MAPK1KDM4EHTT | |
| SCHEMBL7981028 | 0.87 | TP53 (0.39) | KMT2ATP53GAAALDH1A1MAPK1 | |
| SCHEMBL7961053 | 0.86 | MEN1 (0.42) | KMT2AALDH1A1MAPK1KDM4EHTT | |
| SCHEMBL7971732 | 0.84 | HRH1 (0.38) | KMT2ATP53GAAALDH1A1MAPK1 | |
| SCHEMBL6998261 | 0.84 | SMN1; SMN2 (0.46) | KMT2AGAAALDH1A1MAPK1HTT | |
| SCHEMBL7954561 | 0.84 | MEN1 (0.40) | KMT2AGAAMAPK1MEN1USP2 | |
| SCHEMBL7495346 | 0.84 | ALDH1A1 (0.43) | TP53ALDH1A1MAPK1KDM4EHTT | |
| SCHEMBL6995389 | 0.83 | KMT2A (0.39) | KMT2AMAPK1HTTMEN1LMNA |
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-6211199-B1 | HISTAMINE AND TACHYKININ RECEPTOR ANTAGONISTS; ANTIASTHMATICS, ANTIEMETICS; RESPIRATORY SYSTEM DISORDERS, INFLAMMATORY BOWEL DISEASE, CONJUNCTIVITIS | AVENTIS PHARMACEUTICALS INC. | 2001-04-03 | — | — | US | disclosed |