Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 9/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.44 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.31 |
| ▸ | HTR3B | O95264 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.31 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29950798 | 0.79 | CHRM2 (0.56) | HTR1BCHRM2CHRM1CHRM3MRGPRX4 | |
| SCHEMBL29017001 | 0.77 | HTR1B (0.53) | HTR1BCHRM2CHRM1CHRM3MRGPRX4 | |
| SCHEMBL29016962 | 0.75 | HTR1B (0.51) | HTR1BCHRM2CHRM1CHRM3MRGPRX4 | |
| SCHEMBL4328740 | 0.74 | HTR1B (0.53) | HTR1BCHRM2CHRM1CHRM3MRGPRX4 | |
| SCHEMBL9113003 | 0.74 | HTR1B (0.43) | HTR1BCHRM2CHRM1CHRM3MRGPRX4 | |
| SCHEMBL9111859 | 0.74 | HTR1B (0.43) | HTR1BCHRM2CHRM1CHRM3MRGPRX4 | |
| SCHEMBL8790466 | 0.72 | KDM4E (0.48) | CYP2A6KDM4E | |
| SCHEMBL957248 | 0.71 | HTR1B (0.53) | HTR1BCHRM2CHRM1CHRM3MRGPRX4 | |
| SCHEMBL17613378 | 0.71 | HTR1B (0.53) | HTR1BCHRM2CHRM1CHRM3MRGPRX4 | |
| SCHEMBL507041 | 0.71 | HTR1B (0.53) | HTR1BCHRM2CHRM1CHRM3MRGPRX4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2379542-A1 | NOVEL OXIME DERIVATIVES | Cadila Healthcare Limited (IN) | 2011-10-26 | — | — | EP | disclosed |
| WO-2010084512-A1 | NOVEL OXIME DERIVATIVES | CADILA HEALTHCARE LIMITED (IN) | 2010-07-29 | — | — | WO | disclosed |