Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A1 | P18405 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | RORA | P35398 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | RORB | Q92753 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9844694 | 0.78 | HRH3 (0.47) | CYP1A2HRH3AKR1C3AKR1C2CYP2D6 | |
| SCHEMBL18850960 | 0.74 | HRH3 (0.43) | HRH3CYP2D6 | |
| SCHEMBL26433370 | 0.72 | HTR2A (0.43) | CYP1A2CYP2A6AKR1C3AKR1C2ALOX5 | |
| SCHEMBL9736347 | 0.70 | GALR3 (0.41) | HRH3CYP2D6ALDH1A1HPGDKDM4E | |
| SCHEMBL9387355 | 0.68 | HTR2A (0.41) | CYP1A2ALDH1A1L3MBTL1KDM4EKMT2A | |
| SCHEMBL2019621 | 0.67 | MAOB (0.51) | SRD5A1CYP1A2HRH3ALOX5CYP2D6 | |
| SCHEMBL17368515 | 0.67 | RPS6KA3 (0.50) | HRH3CYP2D6 | |
| SCHEMBL13226939 | 0.66 | HTR2A (0.62) | CYP1A2CYP2A6HRH3 | |
| SCHEMBL18463618 | 0.64 | SRD5A1 (0.36) | SRD5A1ALOX5 | |
| SCHEMBL9735954 | 0.63 | S1PR1 (0.35) | CYP1A2CYP2A6ALDH1A1HPGDNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992021678-A1 | LIPOXYGENASE INHIBITING PYRROLO [1,2a]INDOLE COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 1992-12-10 | — | — | WO | disclosed |