Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OGA | O60502 | 4/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | FASN | P49327 | 1/20 | 0.39 |
| ▸ | CRBN | Q96SW2 | 5/20 | 0.39 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.38 |
| ▸ | DDB1 | Q16531 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.36 |
| ▸ | IP6K3 | Q96PC2 | 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 | |
|---|---|---|---|---|
| SCHEMBL15548204 | 0.80 | ADRB1 (0.46) | OGAMMP2ADAMTS5CYP3A4CYP2C9 | |
| SCHEMBL30609653 | 0.80 | ADRB1 (0.46) | OGAMMP2ADAMTS5CYP3A4CYP2C9 | |
| SCHEMBL23075831 | 0.78 | MMP2 (0.45) | OGAMMP2ADAMTS5LMNACYP3A4 | |
| SCHEMBL5798538 | 0.76 | PDE3B (0.46) | OGAMMP2ADAMTS5LMNACYP3A4 | |
| SCHEMBL17543290 | 0.74 | MEN1 (0.63) | OGALMNAGAAIP6K1IP6K3 | |
| SCHEMBL21091414 | 0.74 | GAA (0.57) | OGALMNACYP3A4GAACYP2C9 | |
| SCHEMBL7961838 | 0.74 | DRD3 (0.47) | OGALMNAGAAHTTALDH1A1 | |
| SCHEMBL28983139 | 0.73 | MMP2 (0.46) | OGAMMP2ADAMTS5LMNACYP3A4 | |
| SCHEMBL30410568 | 0.73 | MMP2 (0.46) | OGAMMP2ADAMTS5LMNACYP3A4 | |
| SCHEMBL23075769 | 0.71 | CRBN (0.64) | MMP2ADAMTS5CRBNDDB1SCN9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-1342074-A | Antidepressant heterocyclic compounds | BRISTOL MYERS SQUIBB CO (US) | 2002-03-27 | — | — | CN | disclosed |
| US-6225324-B1 | POTENT INHIBITION OF 5-HT REUPTAKE; 1,3-DISUBSTITUTED PYRROLIDINE, 1,4-DISUBSTITUTED PIPERIDINE, OR 1,4-DISUBSTITUTED HEXAHYDROAZEPINE DERIVATIVES | BRISTOL-MYERS SQUIBB COMPANY | 2001-05-01 | — | — | US | disclosed |