Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.48 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | CTSH | P09668 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | METAP2 | P50579 | 1/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.30 |
| ▸ | TYR | P14679 | 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL29152728 | 0.69 | KMT2A (0.49) | KMT2AOPRK1CTSBCTSHNQO2 | |
| SCHEMBL3275602 | 0.69 | KMT2A (0.77) | KMT2AOPRK1CTSBCTSHMEN1 | |
| SCHEMBL7362134 | 0.68 | KDM4E (0.32) | KMT2AMEN1KDM4EALDH1A1MAPT | |
| SCHEMBL7171554 | 0.68 | KMT2A (0.74) | KMT2AOPRK1CTSBCTSHMEN1 | |
| SCHEMBL8090833 | 0.66 | KMT2A (1.00) | KMT2AOPRK1CTSBCTSHMEN1 | |
| SCHEMBL17506427 | 0.66 | KMT2A (0.50) | KMT2AOPRK1CTSBCTSHMEN1 | |
| Hydrochloric Acid SCHEMBL30894755 | 0.65 | KMT2A (0.59) | KMT2AOPRK1CTSBCTSHMEN1 | |
| Hydrochloric Acid SCHEMBL11130882 | 0.65 | KMT2A (0.59) | KMT2AOPRK1CTSBCTSHMEN1 | |
| SCHEMBL1461144 | 0.64 | KMT2A (0.67) | KMT2AOPRK1CTSBCTSHNPC1 | |
| SCHEMBL31556365 | 0.64 | CCR1 (0.41) | KMT2AOPRK1CTSBCTSHMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0952832-A1 | QUINOLINE CARBOXAMIDES AS TNF INHIBITORS AND AS PDE-IV INHIBITORS | Darwin Discovery Limited (GB) | 1999-11-03 | — | — | EP | disclosed |
| WO-1997044036-A1 | QUINOLINE CARBOXAMIDES AS TNF INHIBITORS AND AS PDE-IV INHIBITORS | DARWIN DISCOVERY LIMITED (GB) | 1997-11-27 | — | — | WO | disclosed |