Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 7/20 | 0.58 |
| ▸ | CYP1B1 | Q16678 | 6/20 | 0.58 |
| ▸ | NQO2 | P16083 | 4/20 | 0.58 |
| ▸ | TTR | P02766 | 2/20 | 0.58 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.58 |
| ▸ | MYC | P01106 | 1/20 | 0.58 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.48 |
| ▸ | NQO1 | P15559 | 1/20 | 0.48 |
| ▸ | TUBB4A | P04350 | 3/20 | 0.46 |
| ▸ | TUBB | P07437 | 3/20 | 0.46 |
| ▸ | TUBA3C | P0DPH7 | 3/20 | 0.46 |
| ▸ | TUBA1B | P68363 | 3/20 | 0.46 |
| ▸ | TUBA4A | P68366 | 3/20 | 0.46 |
| ▸ | TUBB4B | P68371 | 3/20 | 0.46 |
| ▸ | TUBB3 | Q13509 | 3/20 | 0.46 |
| ▸ | TUBB2A | Q13885 | 3/20 | 0.46 |
| ▸ | TUBB8 | Q3ZCM7 | 3/20 | 0.46 |
| ▸ | TUBA3E | Q6PEY2 | 3/20 | 0.46 |
| ▸ | TUBA1A | Q71U36 | 3/20 | 0.46 |
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 | 1.00 | CYP1A1 (0.58) | CYP1A1CYP1B1NQO2TTRABCG2 | |
| SCHEMBL3358376 | 0.88 | PDE4B (0.46) | CYP1A1CYP1B1NQO2TTRABCG2 | |
| SCHEMBL3358380 | 0.88 | PDE4B (0.46) | CYP1A1CYP1B1NQO2TTRABCG2 | |
| SCHEMBL15224181 | 0.85 | ESR1 (0.54) | CYP1A1CYP1B1NQO2TTRALOX5 | |
| SCHEMBL3358346 | 0.85 | PTPN1 (0.46) | CYP1A1CYP1B1NQO2TTRABCG2 | |
| SCHEMBL3358340 | 0.85 | PTPN1 (0.46) | CYP1A1CYP1B1NQO2TTRABCG2 | |
| SCHEMBL24366316 | 0.83 | PDE4B (0.55) | CYP1A1CYP1B1PDE4BCYP1A2CYP19A1 | |
| SCHEMBL24588569 | 0.83 | PDE4B (0.51) | PDE4BCYP1A2 | |
| SCHEMBL667201 | 0.83 | ALDH1A1 (0.54) | TTRPDE4B | |
| SCHEMBL24367560 | 0.81 | KDM4E (0.60) | PDE4B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010046926-A2 | NOVEL STILBENE ANALOGS | APTUIT LAURUS PVT LTD (IN) | 2010-04-29 | — | — | WO | claimed |
| WO-2010046926-A2 | NOVEL STILBENE ANALOGS | APTUIT LAURUS PVT LTD (IN) | 2010-04-29 | — | — | WO | disclosed |