Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | IDO1 | P14902 | 2/20 | 0.49 |
| ▸ | TDO2 | P48775 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MIF | P14174 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | BTK | Q06187 | 1/20 | 0.38 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24204595 | 0.84 | NPC1 (0.50) | NPC1RAB9AIDO1TDO2CYP1A2 | |
| SCHEMBL30365932 | 0.84 | NPC1 (0.50) | NPC1RAB9AIDO1TDO2CYP1A2 | |
| SCHEMBL25520061 | 0.83 | NPC1 (0.49) | NPC1RAB9AIDO1TDO2CYP1A2 | |
| SCHEMBL31010850 | 0.82 | NPC1 (0.51) | NPC1RAB9AIDO1TDO2CYP1A2 | |
| SCHEMBL25522194 | 0.81 | AR (0.50) | NPC1RAB9AIDO1TDO2CYP1A2 | |
| SCHEMBL25524104 | 0.80 | PDGFRB (0.51) | NPC1RAB9ACYP1A2CYP2A6KDM4E | |
| SCHEMBL27253275 | 0.80 | NPC1 (0.46) | NPC1RAB9AIDO1TDO2CYP1A2 | |
| SCHEMBL31010848 | 0.80 | NPC1 (0.46) | NPC1RAB9AIDO1TDO2CYP1A2 | |
| SCHEMBL31010855 | 0.79 | NPC1 (0.47) | NPC1RAB9AIDO1TDO2CYP1A2 | |
| SCHEMBL29493149 | 0.76 | NPC1 (0.63) | NPC1RAB9AIDO1TDO2CYP1A2 |
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-2023086428-A2 | NOVEL MODULATORS OF THE ARYL HYDROCARBON RECEPTOR AND METHODS OF USE THEREOF | ALLIANTHERA (SUZHOU) BIOPHARMACEUTICAL CO., LTD. (CN) | 2023-05-19 | — | — | WO | disclosed |