Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | UTS2R | Q9UKP6 | 3/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | PDE2A | O00408 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9211495 | 0.97 | HTR1A (0.42) | HTR1ACHRNA7CRHBPCRHR2SMN1; SMN2 | |
| SCHEMBL9205651 | 0.94 | HTR1A (0.38) | HTR1ACHRNA7CRHBPCRHR2SMN1; SMN2 | |
| SCHEMBL9214402 | 0.92 | HTR1A (0.37) | HTR1ACHRNA7CRHBPCRHR2SMN1; SMN2 | |
| SCHEMBL9207815 | 0.91 | HCN4 (0.40) | HTR1ACHRNA7CRHBPCRHR2SMN1; SMN2 | |
| SCHEMBL9215411 | 0.91 | HTR1A (0.38) | HTR1ACHRNA7CRHBPCRHR2SMN1; SMN2 | |
| SCHEMBL9215793 | 0.90 | HTR1A (0.39) | HTR1ACHRNA7CRHBPCRHR2SMN1; SMN2 | |
| SCHEMBL9208988 | 0.89 | HCN4 (0.41) | HTR1ACHRNA7SMN1; SMN2MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL9740138 | 0.88 | CYP3A4 (0.41) | HTR1ACRHBPCRHR2SMN1; SMN2MEN1 | |
| SCHEMBL9206684 | 0.88 | HTR1A (0.41) | HTR1ACHRNA7CRHBPCRHR2SMN1; SMN2 | |
| SCHEMBL9207476 | 0.87 | HTR1A (0.33) | HTR1AUTS2RMEN1KMT2ACXCR4 |
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-0292840-B1 | Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation | THOMAE GMBH DR K (DE) | 1995-08-09 | — | — | EP | disclosed |
| US-5175157-A | Cardiovascular disorders | BOEHRINGER INGELHEIM GMBH (DE) | 1992-12-29 | — | — | US | disclosed |