Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.54 |
| ▸ | NQO2 | P16083 | 4/20 | 0.54 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.54 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.54 |
| ▸ | AHR | P35869 | 3/20 | 0.54 |
| ▸ | ABL1 | P00519 | 2/20 | 0.54 |
| ▸ | TTR | P02766 | 2/20 | 0.54 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.54 |
| ▸ | BCR | P11274 | 2/20 | 0.54 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.54 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.54 |
| ▸ | TUBB | P07437 | 1/20 | 0.54 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.54 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.54 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.54 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.54 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL3360303 | 0.85 | CYP1A1 (0.58) | ESR1NQO2CYP1A1CYP1B1AHR | |
| SCHEMBL3360306 | 0.85 | CYP1A1 (0.58) | ESR1NQO2CYP1A1CYP1B1AHR | |
| SCHEMBL3358376 | 0.83 | PDE4B (0.46) | ESR1NQO2CYP1A1CYP1B1AHR | |
| SCHEMBL3358380 | 0.83 | PDE4B (0.46) | ESR1NQO2CYP1A1CYP1B1AHR | |
| SCHEMBL813805 | 0.83 | NPC1 (0.46) | CYP19A1KDM4EMEN1NPC1GAA | |
| SCHEMBL3358346 | 0.79 | PTPN1 (0.46) | NQO2CYP1A1CYP1B1ABL1TTR | |
| SCHEMBL3358340 | 0.79 | PTPN1 (0.46) | NQO2CYP1A1CYP1B1ABL1TTR | |
| SCHEMBL9876349 | 0.79 | KDM4E (0.39) | KDM4EMEN1NPC1RAB9AKMT2A | |
| SCHEMBL25196646 | 0.78 | F3 (0.61) | CYP1A1CYP1B1CYP1A2MAOAMAOB | |
| SCHEMBL21527703 | 0.78 | F3 (0.61) | CYP1A1CYP1B1CYP1A2MAOAMAOB |
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 |
|---|---|---|---|---|---|---|---|
| US-8524782-B2 | Key intermediate for the preparation of Stilbenes, solid forms of Pterostilbene, and methods for making the same | LAURUS LABS PRIVATE LIMITED (IN) | 2013-09-03 | — | — | US | disclosed |