Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | TRPM5 | Q9NZQ8 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL31757630 | 0.81 | EGFR (0.43) | NPC1RAB9ATRPM5IDO1 | |
| SCHEMBL21646370 | 0.77 | ABL1 (0.38) | NPC1RAB9ATRPM5IDO1 | |
| SCHEMBL29941780 | 0.69 | CA12 (0.44) | — | |
| SCHEMBL29442070 | 0.69 | KDM4E (0.44) | NPC1RAB9A | |
| SCHEMBL24783511 | 0.67 | ALDH1A1 (0.33) | — | |
| SCHEMBL31611304 | 0.65 | TRPM5 (0.50) | NPC1RAB9ATRPM5 | |
| SCHEMBL24463586 | 0.65 | CYP1A1 (0.34) | — | |
| SCHEMBL21267380 | 0.65 | AKR1C3 (0.34) | NPC1RAB9AIDO1 | |
| SCHEMBL31125665 | 0.65 | CA12 (0.43) | — | |
| SCHEMBL28590491 | 0.65 | CA12 (0.43) | — |
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-2021039961-A1 | RING-FUSED PYRAZOLE DERIVATIVE | 大日本住友製薬株式会社 | 2021-03-04 | — | — | WO | disclosed |