Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRB2 | P62993 | 2/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA3 | P07451 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | CCR4 | P51679 | 2/20 | 0.35 |
| ▸ | MC4R | P32245 | 1/20 | 0.35 |
| ▸ | MC5R | P33032 | 1/20 | 0.35 |
| ▸ | MC3R | P41968 | 1/20 | 0.35 |
| ▸ | MC1R | Q01726 | 1/20 | 0.35 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7283712 | 0.90 | CA12 (0.38) | MTNR1ACA12CA1CA2CA3 | |
| SCHEMBL7274864 | 0.88 | NAMPT (0.40) | MTNR1AITGB3ITGA2BHDAC3HDAC1 | |
| SCHEMBL7275503 | 0.87 | GBA1 (0.40) | HDAC3HDAC1HDAC8HDAC6 | |
| SCHEMBL7274136 | 0.87 | HDAC1 (0.39) | MC4RMC5RMC3RMC1RITGB3 | |
| SCHEMBL7272690 | 0.86 | NAMPT (0.41) | ITGB3ITGA2BHDAC3HDAC1HDAC2 | |
| SCHEMBL7284310 | 0.86 | NAMPT (0.41) | ITGB3ITGA2BHDAC3HDAC1HDAC2 | |
| SCHEMBL7272971 | 0.86 | NAMPT (0.41) | ITGB3ITGA2BHDAC3HDAC1HDAC2 | |
| SCHEMBL7274469 | 0.85 | LMNA (0.42) | ITGB3ITGA2BHDAC3HDAC1HDAC2 | |
| SCHEMBL7282847 | 0.83 | HDAC3 (0.41) | MTNR1AITGB3ITGA2BHDAC3HDAC4 | |
| SCHEMBL7274533 | 0.82 | TSHR (0.40) | MTNR1AITGB3ITGA2B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5591769-A | PYRROLIDINE DERIVATIVES; ANTICOAGULANTS | KARL THOMAE GMBH (DE) | 1997-01-07 | — | — | US | disclosed |
| US-5541343-A | ANTIAGGLOMERANTS FOR CELLS OR ANTICOAGULANTS | KARL THOMAE GMBH (DE) | 1996-07-30 | — | — | US | disclosed |
| EP-0483667-A2 | Cyclic imino derivatives, process for their preparation and drugs containing them | Dr. Karl Thomae GmbH (DE) | 1992-05-06 | — | — | EP | disclosed |