Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 10/20 | 0.39 |
| ▸ | ATR | Q13535 | 1/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.35 |
| ▸ | KMO | O15229 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | F10 | P00742 | 1/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.34 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL18655294 | 0.87 | FYN (0.40) | TGFBR1FYN | |
| SCHEMBL18654758 | 0.85 | TGFBR1 (0.43) | TGFBR1ATRNTRK1FYNF2 | |
| SCHEMBL18654323 | 0.82 | NTRK1 (0.35) | ATRNTRK1HDAC1F2F10 | |
| SCHEMBL18654566 | 0.82 | TGFBR1 (0.38) | TGFBR1ATRNTRK1FYNF2 | |
| SCHEMBL14897192 | 0.81 | TGFBR1 (0.46) | TGFBR1ATRNTRK1KMOHDAC1 | |
| SCHEMBL14896756 | 0.81 | ATR (0.46) | TGFBR1ATRKMOFYNF2 | |
| SCHEMBL14896955 | 0.79 | TGFBR1 (0.44) | TGFBR1ATRNTRK1KMO | |
| SCHEMBL14897194 | 0.79 | ATR (0.44) | TGFBR1ATRKMOFYNHDAC1 | |
| SCHEMBL14896709 | 0.79 | TGFBR1 (0.41) | TGFBR1ATRNTRK1KMOHDAC1 | |
| SCHEMBL14897560 | 0.78 | TGFBR1 (0.41) | TGFBR1ATRNTRK1KMOHDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2768509-B1 | SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AND ANALOGUES AS SIRTUIN MODULATORS | GLAXOSMITHKLINE LLC (US) | 2017-03-22 | — | — | EP | disclosed |