Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | LDHA | P00338 | 3/20 | 0.38 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.35 |
| ▸ | CDK2 | P24941 | 3/20 | 0.35 |
| ▸ | CCNA1 | P78396 | 3/20 | 0.35 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.35 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.35 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10255552 | 0.93 | CYP2C9 (0.40) | CYP2C9CYP2C19PIN1CCNA2CDK2 | |
| SCHEMBL11947999 | 0.91 | CDK2 (0.39) | CYP2C9CYP2C19CCNA2CDK2CCNA1 | |
| SCHEMBL4100668 | 0.90 | CYP2C9 (0.51) | CYP2C9CYP2C19NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11948008 | 0.88 | LRRK2 (0.38) | CYP2C9CYP2C19CDK2CDK1 | |
| SCHEMBL4116031 | 0.84 | CYP2C9 (0.53) | CYP2C9CYP2C19CCNA2CDK2CCNA1 | |
| SCHEMBL10255276 | 0.83 | CCNK (0.35) | CYP2C9CYP2C19CCNA2CDK2CCNA1 | |
| SCHEMBL11936697 | 0.83 | NPC1 (0.46) | CYP2C9CYP2C19PIN1NPC1RAB9A | |
| SCHEMBL11947385 | 0.82 | ROCK2 (0.38) | CYP2C9CYP2C19CDK2CDK1ABCC3 | |
| SCHEMBL4106026 | 0.81 | CYP2C9 (0.49) | CYP2C9CYP2C19CCNA2CDK2CCNA1 | |
| SCHEMBL10256560 | 0.81 | CYP2C9 (0.44) | CYP2C9CYP2C19CCNA2CDK2CCNA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2220091-B1 | REVERSE TRANSCRIPTASE INHIBITORS | ARDEA BIOSCIENCES INC (US) | 2012-07-25 | — | — | EP | disclosed |
| WO-2009079412-A2 | REVERSE TRANSCRIPTASE INHIBITORS | ARDEA BIOSCIENCES INC. (US) | 2009-06-25 | — | — | WO | disclosed |