Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 4/20 | 0.50 |
| ▸ | NPY5R | Q15761 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.48 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.43 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | LDHA | P00338 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | MMP14 | P50281 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.42 |
| ▸ | DHODH | Q02127 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10937354 | 0.88 | PIN1 (0.51) | PIN1NPY5RKMT2AHCRTR1PKN1 | |
| SCHEMBL10939665 | 0.86 | NPY5R (0.49) | PIN1NPY5RKMT2AHCRTR1PKN1 | |
| SCHEMBL8963968 | 0.85 | PIN1 (0.69) | PIN1KDM4EMAPT | |
| SCHEMBL10938042 | 0.85 | NPY5R (0.48) | PIN1NPY5RKMT2AHCRTR1PKN1 | |
| SCHEMBL10938799 | 0.84 | NPY5R (0.47) | PIN1NPY5RKMT2AHCRTR1PKN1 | |
| SCHEMBL10679369 | 0.83 | PIN1 (0.55) | PIN1NPY5RKMT2AHCRTR1PKN1 | |
| SCHEMBL10649656 | 0.83 | PIN1 (0.72) | PIN1NPY5RKMT2AHCRTR1PKN1 | |
| SCHEMBL10940084 | 0.83 | FAAH (0.47) | PIN1NPY5RKMT2AHCRTR1HPGD | |
| SCHEMBL3418983 | 0.82 | NPY5R (0.50) | PIN1NPY5RKMT2AHCRTR1PKN1 | |
| SCHEMBL8963720 | 0.80 | PIN1 (0.71) | PIN1HCRTR1HPGDALDH1A1KDM4E |
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-4732895-A | α-[5-methyl-2-(pyridinyl)-1H-imidazol-4-yl]substituted-1-piperazineethanols useful for treating hypertension | AMERICAN CYANAMID COMPANY (US) | 1988-03-22 | — | — | US | disclosed |