Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.31 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.31 |
| ▸ | GRK2 | P25098 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14757116 | 1.00 | MAOA (0.31) | MAOAMAOBTGFBR1ACVR1GRK2 | |
| Hydrochloric Acid SCHEMBL14741358 | 0.99 | MAOA (0.31) | MAOAMAOBTGFBR1ACVR1GRK2 | |
| Hydrochloric Acid SCHEMBL14741357 | 0.99 | MAOA (0.31) | MAOAMAOBTGFBR1ACVR1GRK2 | |
| SCHEMBL14745807 | 0.87 | IP6K1 (0.35) | MAOAMAOBTGFBR1ACVR1KMT2A | |
| Hydrochloric Acid SCHEMBL18628183 | 0.85 | TGFBR1 (0.33) | TGFBR1ACVR1 | |
| SCHEMBL17593319 | 0.84 | SLC16A3 (0.32) | — | |
| SCHEMBL17593332 | 0.84 | KDM4E (0.30) | KMT2A | |
| SCHEMBL14757061 | 0.84 | SLC16A3 (0.32) | — | |
| SCHEMBL14756992 | 0.84 | KDM4E (0.30) | KMT2A | |
| SCHEMBL14746089 | 0.84 | ACHE (0.31) | MAOB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016039938-A1 | POLYCYCLIC 2-PYRIDINONE ANTIBACTERIAL COMPOUNDS | PTC THERAPEUTICS, INC. (US) | 2016-03-17 | — | — | WO | disclosed |