Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 13/20 | 0.61 |
| ▸ | MAOB | P27338 | 13/20 | 0.61 |
| ▸ | PRKCI | P41743 | 1/20 | 0.61 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.54 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.53 |
| ▸ | GRM5 | P41594 | 1/20 | 0.51 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | CASP7 | P55210 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL883774 | 0.88 | CASP1 (0.59) | MAOAMAOBPRKCIHSD17B1GRM5 | |
| SCHEMBL8303576 | 0.84 | MAOA (0.53) | MAOAMAOBPRKCIHSD17B1CYP2A6 | |
| SCHEMBL5536711 | 0.78 | MAOA (0.63) | MAOAMAOBPRKCIHSD17B1CYP2A6 | |
| SCHEMBL1798900 | 0.76 | MAOA (0.67) | MAOAMAOBPRKCIHSD17B1CYP2A6 | |
| SCHEMBL1027718 | 0.76 | MAOA (0.61) | MAOAMAOBPRKCIHSD17B1CYP2A6 | |
| SCHEMBL5858951 | 0.76 | MAOA (0.61) | MAOAMAOBPRKCIHSD17B1CYP2A6 | |
| SCHEMBL228128 | 0.76 | MAOA (1.00) | MAOAMAOBPRKCIHSD17B1CYP2A6 | |
| SCHEMBL929312 | 0.76 | CASP1 (0.78) | MAOAMAOBPRKCIHSD17B1CYP2A6 | |
| SCHEMBL207834 | 0.76 | MAOA (0.61) | MAOAMAOBPRKCIHSD17B1CYP2A6 | |
| SCHEMBL315877 | 0.76 | MAOA (0.61) | MAOAMAOBPRKCIHSD17B1CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008139941-A1 | SUBSTITUTED IMIDAZOLE COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-11-20 | — | — | WO | disclosed |
| WO-2007125061-A1 | SPIROCOMPOUNDS USEFUL AS MODULATORS FOR DOPAMINE D3 RECEPTORS | GLAXO GROUP LIMITED (GB) | 2007-11-08 | — | — | WO | disclosed |