Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | ECE1 | P42892 | 1/20 | 0.36 |
| ▸ | GPR132 | Q9UNW8 | 6/20 | 0.35 |
| ▸ | BCL2 | P10415 | 1/20 | 0.34 |
| ▸ | GHSR | Q92847 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 2/20 | 0.34 |
| ▸ | CTSB | P07858 | 2/20 | 0.34 |
| ▸ | CTSS | P25774 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CTRC | Q99895 | 1/20 | 0.34 |
| ▸ | CMKLR2 | P46091 | 1/20 | 0.34 |
| ▸ | CMKLR1 | Q99788 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL8561651 | 0.93 | TACR1 (0.42) | TACR1GHSR | |
| SCHEMBL8560379 | 0.92 | CTSL (0.40) | TACR1GHSRCTSLCTSBCTSS | |
| SCHEMBL8562715 | 0.89 | TACR1 (0.41) | TACR1 | |
| Hydrochloric Acid SCHEMBL8567968 | 0.88 | TACR1 (0.41) | TACR1 | |
| SCHEMBL8563536 | 0.88 | TACR1 (0.45) | TACR1GHSRCYP3A4 | |
| SCHEMBL8562851 | 0.87 | TACR1 (0.43) | TACR1CTSLCTSBCTSSCTSK | |
| SCHEMBL8564711 | 0.87 | TACR1 (0.43) | TACR1GHSRCTSSCYP3A4 | |
| SCHEMBL8561512 | 0.87 | CTSD (0.37) | TACR1GHSRCTSS | |
| SCHEMBL8559389 | 0.86 | TACR1 (0.42) | TACR1BCL2GHSRCTSLCTSS | |
| Hydrochloric Acid SCHEMBL8560013 | 0.86 | CTSD (0.37) | TACR1GHSRCTSS |
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 |
|---|---|---|---|---|---|---|---|
| US-5811431-A | Spiro-substituted azacyclic derivatives and their use as therapeutic agents | MERCK SHARP & DOHME LTD. (GB) | 1998-09-22 | — | — | US | disclosed |