Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYSLTR1 | Q9Y271 | 5/20 | 0.78 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.62 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.62 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.62 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.62 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.59 |
| ▸ | MAPT | P10636 | 4/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | NPC1 | O15118 | 3/20 | 0.59 |
| ▸ | TP53 | P04637 | 3/20 | 0.59 |
| ▸ | RAB9A | P51151 | 3/20 | 0.59 |
| ▸ | HPGD | P15428 | 3/20 | 0.59 |
| ▸ | TNKS | O95271 | 3/20 | 0.59 |
| ▸ | MAOB | P27338 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | THRB | P10828 | 2/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10987922 | 0.99 | CYSLTR1 (0.76) | CYSLTR1CYP1A1CYP1A2CYP1B1ABCB1 | |
| SCHEMBL10987884 | 0.89 | CYSLTR1 (0.62) | CYSLTR1CYP1A1CYP1A2CYP1B1ABCB1 | |
| SCHEMBL8807539 | 0.89 | CYSLTR1 (0.69) | CYSLTR1CYP1A1CYP1A2CYP1B1ABCB1 | |
| Hydrochloric Acid SCHEMBL10993975 | 0.88 | CYSLTR1 (0.67) | CYSLTR1CYP1A1CYP1A2CYP1B1ABCB1 | |
| SCHEMBL24533170 | 0.87 | CYSLTR1 (0.73) | CYSLTR1CYP1A1CYP1A2CYP1B1ABCB1 | |
| SCHEMBL10990115 | 0.86 | CYSLTR1 (0.71) | CYSLTR1CYP1A1CYP1A2CYP1B1ABCB1 | |
| SCHEMBL1516397 | 0.85 | CYSLTR1 (0.78) | CYSLTR1CYP1A1CYP1A2CYP1B1ABCB1 | |
| Hydrochloric Acid SCHEMBL10987014 | 0.85 | CYSLTR1 (0.70) | CYSLTR1CYP1A1CYP1A2CYP1B1ABCB1 | |
| Hydrochloric Acid SCHEMBL10995142 | 0.84 | CYSLTR1 (0.76) | CYSLTR1CYP1A1CYP1A2CYP1B1ABCB1 | |
| SCHEMBL10551657 | 0.83 | NTRK1 (0.57) | CYSLTR1CYP1A1CYP1A2CYP1B1ABCB1 |
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-4525356-A | UROGENITAL DISORDERS | HOKURIKU PHARMACEUTICAL CO., LTD. (JP) | 1985-06-25 | — | — | US | disclosed |
| EP-0108986-A1 | N-substituted flavone-8-carboxamides | Hokuriku Pharmaceutical Co.,Ltd (JP) | 1984-05-23 | — | — | EP | disclosed |