Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 7/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.33 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9735960 | 0.75 | S1PR1 (0.36) | S1PR1S1PR5 | |
| SCHEMBL26433370 | 0.65 | HTR2A (0.43) | ALDH1A1ALOX15CYP1A2CYP2A6 | |
| SCHEMBL9736283 | 0.63 | SRD5A1 (0.40) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL21871188 | 0.61 | GPR119 (0.49) | CYP1A2CYP2A6HDAC8 | |
| SCHEMBL30703015 | 0.59 | HTR2A (0.43) | S1PR1 | |
| SCHEMBL16979076 | 0.58 | CYP1A2 (0.44) | KDM4EALDH1A1HPGDALOX15CYP1A2 | |
| SCHEMBL29407167 | 0.57 | CYP2A6 (0.80) | ALDH1A1NPC1RAB9ACYP1A2CYP2A6 | |
| SCHEMBL347592 | 0.57 | CYP2A6 (0.80) | ALDH1A1NPC1RAB9ACYP1A2CYP2A6 | |
| SCHEMBL9613258 | 0.56 | HSD17B10 (0.62) | KDM4EALDH1A1HPGDALOX15CYP1A2 | |
| SCHEMBL27547839 | 0.56 | CYP1A2 (0.61) | ALDH1A1NPC1RAB9ACYP1A2CYP2A6 |
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 |