Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 6/20 | 0.46 |
| ▸ | MAOA | P21397 | 5/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15657685 | 0.82 | TSHR (0.59) | MAOBMAOATSHRMAPTCYP3A4 | |
| SCHEMBL15657161 | 0.82 | TSHR (0.59) | MAOBMAOATSHRMAPTCYP3A4 | |
| SCHEMBL22871613 | 0.82 | CYP3A4 (0.57) | TSHRCYP3A4TDP1CYP19A1SMN1; SMN2 | |
| SCHEMBL200142 | 0.82 | LOXL2 (0.58) | MAOBMAOATSHRLOXL2CYP2A6 | |
| SCHEMBL9432333 | 0.82 | MAOB (0.46) | MAOBMAOATSHRMAPTCYP3A4 | |
| SCHEMBL9714604 | 0.82 | TDP1 (0.43) | MAOBMAPTCYP3A4TDP1NPC1 | |
| SCHEMBL9714736 | 0.81 | MAOA (0.42) | MAOBMAOATSHRCYP3A4TDP1 | |
| Hydrochloric Acid SCHEMBL5143704 | 0.81 | CYP3A4 (0.55) | MAOBMAOATSHRCYP3A4TDP1 | |
| (Chloromethyl)Benzene SCHEMBL304085 | 0.80 | CYP3A4 (0.60) | TSHRCYP3A4TDP1LOXL2CYP19A1 | |
| SCHEMBL11799900 | 0.79 | MAOB (0.52) | MAOBMAOATSHRMAPTCYP3A4 |
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-5166210-A | QUINOLINE DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D4 | RHONE-POULENC RORER PHARMACEUTICALS INC. (US) | 1992-11-24 | — | — | US | disclosed |
| US-5028615-A | Treatment of hypersensitivity | RHONE-POULENC RORER PHARMACEUTICALS INC. (US) | 1991-07-02 | — | — | US | disclosed |