Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.44 |
| ▸ | HPGDS | O60760 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.37 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.37 |
| ▸ | TNKS | O95271 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.37 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8963595 | 0.98 | PIN1 (0.46) | PIN1MAPTNPY5RHPGDSGAA | |
| SCHEMBL6214057 | 0.87 | PIN1 (0.50) | PIN1MAPTNPY5RHPGDSGAA | |
| Hydrochloric Acid SCHEMBL6219341 | 0.85 | PIN1 (0.49) | PIN1MAPTNPY5RHPGDSGAA | |
| Hydrochloric Acid SCHEMBL8963854 | 0.84 | MAPK1 (0.44) | MAPTNPY5RGAANPC1RAB9A | |
| Hydrochloric Acid SCHEMBL8963959 | 0.84 | PIN1 (0.50) | PIN1MAPTNPC1RAB9ASLC9A1 | |
| Hydrochloric Acid SCHEMBL8964187 | 0.83 | PIN1 (0.53) | PIN1NPY5RGAASLC9A1PARP1 | |
| Hydrochloric Acid SCHEMBL8963572 | 0.81 | KDM4E (0.43) | MAPTGAAPOLBNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL8964043 | 0.81 | HDAC6 (0.43) | TNKSPARP1TNKS2ALDH1A1 | |
| SCHEMBL8963701 | 0.81 | PIN1 (0.51) | PIN1MAPTNPY5RHPGDSGAA | |
| Hydrochloric Acid SCHEMBL8963579 | 0.80 | NPC1 (0.45) | GAANPC1RAB9ASLC9A1ALDH1A1 |
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-5091428-A | Calcium channel blockers preferential for cerebral blood vessels | SYNTEX PHARMACEUTICALS, LTD. (BM) | 1992-02-25 | — | — | US | disclosed |