Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9757015 | 0.72 | ALDH1A1 (0.35) | BRD4CREBBPALDH1A1CYP2C9HSD17B10 | |
| SCHEMBL9757013 | 0.72 | GAA (0.39) | ALDH1A1HSD17B10KDM4EKMT2A | |
| SCHEMBL9635626 | 0.71 | KDM4E (0.56) | ALDH1A1KDM4EMAPTKMT2A | |
| SCHEMBL3876493 | 0.59 | CYP1A2 (0.59) | — | |
| SCHEMBL3661382 | 0.59 | CYP1A2 (0.59) | — | |
| SCHEMBL6379983 | 0.59 | CYP1A2 (0.59) | — | |
| SCHEMBL29999108 | 0.59 | BRD4 (0.42) | BRD4CREBBPALDH1A1KDM4EMEN1 | |
| SCHEMBL5679935 | 0.58 | CYP1A2 (0.56) | — | |
| SCHEMBL1634405 | 0.58 | CYP1A2 (0.56) | — | |
| SCHEMBL28661224 | 0.57 | MAPK1 (0.54) | ALDH1A1HSD17B10KDM4EMEN1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991019475-A2 | QUINOLINYL-BENZOHETEROBICYCLIC DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D¿4? | RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) | 1991-12-26 | — | — | WO | disclosed |
| US-5041453-A | Quinolinyl-benzoheterobicyclic derivatives as antagonists of leukotriene D4 | RHONE-POULENC RORER PHARMACEUTICALS INC. (US) | 1991-08-20 | — | — | US | disclosed |