Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYCR1 | P32322 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 7/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.34 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.34 |
| ▸ | GFER | P55789 | 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 | |
|---|---|---|---|---|
| SCHEMBL19337454 | 0.81 | ALDH1A1 (0.46) | MAPTLMNAALDH1A1KDM4ERAB9A | |
| SCHEMBL10795320 | 0.79 | PYCR1 (0.56) | PYCR1MAPTTAAR1ALDH1A1KDM4E | |
| SCHEMBL2552222 | 0.79 | APP (0.44) | MAPTTAAR1ALDH1A1KDM4ERAB9A | |
| SCHEMBL27854759 | 0.79 | APP (0.44) | MAPTLMNAALDH1A1KDM4EHPGD | |
| SCHEMBL3928290 | 0.78 | CA12 (0.47) | TAAR1ALDH1A1RAB9AMEN1KMT2A | |
| Water SCHEMBL27734904 | 0.78 | CYP2A6 (0.33) | ALDH1A1CYP2A6CYP2A13 | |
| SCHEMBL27675658 | 0.75 | CYP2A6 (0.30) | CYP2A6CYP2A13 | |
| SCHEMBL27913496 | 0.75 | NPC1 (0.47) | MAPTALDH1A1HPGDRAB9AL3MBTL1 | |
| SCHEMBL29956555 | 0.75 | CYP2A6 (0.39) | LMNAALDH1A1KDM4ECYP2A6KMT2A | |
| SCHEMBL23953832 | 0.74 | KDM1A (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1168667-A | Pyridopyrimidones, quinolines and fused N-heretocycles as bradykinin antagonists | FUJISAWA PHARMACEUTICAL CO (JP) | 1997-12-24 | — | — | CN | disclosed |