Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DVL1 | O14640 | 2/20 | 0.38 |
| ▸ | DVL3 | Q92997 | 2/20 | 0.38 |
| ▸ | BCL2 | P10415 | 1/20 | 0.38 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | MLKL | Q8NB16 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.35 |
| ▸ | PPARG | P37231 | 5/20 | 0.35 |
| ▸ | PTGES | O14684 | 3/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29381538 | 0.89 | DVL1 (0.52) | DVL1DVL3EGFRCDK2PPARG | |
| SCHEMBL1913466 | 0.89 | DVL1 (0.52) | DVL1DVL3EGFRCDK2PPARG | |
| SCHEMBL10291567 | 0.75 | DVL1 (0.48) | DVL1DVL3MCL1EGFRCDK2 | |
| SCHEMBL10291566 | 0.72 | BCL2 (0.43) | DVL1DVL3BCL2BCL2L1MCL1 | |
| SCHEMBL3078012 | 0.68 | DVL1 (0.60) | DVL1DVL3BCL2MCL1EGFR | |
| SCHEMBL28262029 | 0.66 | ALDH1A1 (0.41) | GABRA1GABRB2KDM4EALDH1A1HPGD | |
| SCHEMBL19511634 | 0.64 | TRPA1 (0.49) | PPARGPTGESALOX5 | |
| SCHEMBL6930924 | 0.64 | CYP1A2 (0.47) | PPARGPTGESALOX5HPGD | |
| SCHEMBL6671960 | 0.61 | TRPA1 (0.58) | EGFRKDM4EALDH1A1HSD17B10 | |
| SCHEMBL5787858 | 0.61 | CSNK1E (0.51) | PPARGPTGESALOX5HPGD |
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-8211934-B2 | Small molecule inhibition of PDZ-domain interaction | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2012-07-03 | — | — | US | disclosed |