Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | TNNI3 | P19429 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TNNT2 | P45379 | 1/20 | 0.38 |
| ▸ | TNNC1 | P63316 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 3/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CRHR1 | P34998 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14206651 | 0.87 | MAPK8 (0.43) | SMN1; SMN2KMT2ANPSR1MEN1TNNI3 | |
| SCHEMBL3366146 | 0.85 | CRHR1 (0.43) | SMN1; SMN2CNR1CHRM3CRHR1 | |
| Hydrochloric Acid SCHEMBL3366143 | 0.84 | CRHR1 (0.43) | SMN1; SMN2CNR1CHRM3CRHR1 | |
| SCHEMBL3365373 | 0.81 | CRHR1 (0.46) | CNR1CRHR1 | |
| SCHEMBL3364385 | 0.79 | CRHR1 (0.41) | CNR1CRHR1 | |
| SCHEMBL4697476 | 0.79 | CYP2A13 (0.46) | SMN1; SMN2MAPK1L3MBTL1NPC1RAB9A | |
| SCHEMBL3364388 | 0.76 | CRHR1 (0.48) | CRHR1 | |
| SCHEMBL8295013 | 0.76 | CRHR1 (0.44) | SMN1; SMN2CNR1CHRM3HPGDCRHR1 | |
| SCHEMBL4698423 | 0.75 | NPC1 (0.53) | SMN1; SMN2KMT2AMEN1MAPK1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL3365148 | 0.75 | CRHR1 (0.47) | CRHR1 |
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-1656353-B1 | GABANERGIC MODULATORS | HOFFMANN LA ROCHE (CH) | 2010-01-27 | — | — | EP | claimed |