Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 2/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.43 |
| ▸ | TACR1 | P25103 | 4/20 | 0.40 |
| ▸ | MGAM | O43451 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SI | P14410 | 1/20 | 0.39 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.39 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.36 |
| ▸ | HTR5A | P47898 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL8963860 | 0.90 | PIN1 (0.43) | PIN1SLC6A4SLC6A2TACR1NPY5R | |
| SCHEMBL8963679 | 0.89 | MEN1 (0.42) | PIN1SLC6A4SLC6A2NPY5RKMT2A | |
| SCHEMBL8963979 | 0.89 | CYP2D6 (0.42) | PIN1SLC6A4SLC6A2NPY5RHTR1A | |
| SCHEMBL8963650 | 0.89 | CHEK2 (0.40) | SLC6A4SLC6A2MGAMGAASI | |
| SCHEMBL8964138 | 0.87 | SLC6A4 (0.38) | PIN1SLC6A4SLC6A2TACR1NPY5R | |
| Hydrochloric Acid SCHEMBL8963543 | 0.86 | PIN1 (0.44) | PIN1SLC6A4SLC6A2TACR1MGAM | |
| SCHEMBL8963561 | 0.86 | SLC6A2 (0.47) | PIN1SLC6A4SLC6A2SLC9A1HTR1A | |
| SCHEMBL8964174 | 0.86 | TACR1 (0.38) | PIN1SLC6A4SLC6A2TACR1NPY5R | |
| SCHEMBL8963792 | 0.85 | PIN1 (0.47) | PIN1SLC6A4TACR1HTR2CHTR3A | |
| SCHEMBL8963580 | 0.84 | PRMT5 (0.40) | SLC6A4SLC6A2TACR1KMT2AMEN1 |
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-5514800-A | CALCIUM CHANNEL BLOCKERS, CEREBRAL ISCHEMIA | SYNTEX PHARMACEUTICALS, LTD. (GB) | 1996-05-07 | — | — | US | disclosed |