Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPSAB1 | Q15661 | 7/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CCR5 | P51681 | 1/20 | 0.42 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.42 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.42 |
| ▸ | F10 | P00742 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7021172 | 0.93 | TPSAB1 (0.53) | TPSAB1F10 | |
| Hydrochloric Acid SCHEMBL4402047 | 0.92 | TPSAB1 (0.52) | TPSAB1F10 | |
| SCHEMBL7027368 | 0.88 | TPSAB1 (0.45) | TPSAB1CA12CA1CA2CA7 | |
| Hydrochloric Acid SCHEMBL4395982 | 0.87 | TPSAB1 (0.44) | TPSAB1CA12CA1CA2CA7 | |
| SCHEMBL1872130 | 0.86 | HPN (0.47) | PARP1CA12CA1CA2CA7 | |
| Hydrochloric Acid SCHEMBL1867557 | 0.85 | HPN (0.46) | PARP1CA12CA1CA2CA7 | |
| SCHEMBL6501829 | 0.85 | TPSAB1 (0.42) | TPSAB1PARP1CA12CA1CA2 | |
| SCHEMBL7025350 | 0.84 | TPSAB1 (0.42) | TPSAB1PARP1CA12CA1CA2 | |
| SCHEMBL6498941 | 0.84 | DRD2 (0.52) | PARP1NPC1RAB9ACCR5PARP14 | |
| Hydrochloric Acid SCHEMBL7107726 | 0.84 | TPSAB1 (0.41) | TPSAB1PARP1CA12CA1CA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1296972-A1 | ARYLMETHYLAMINE DERIVATIVES FOR USE AS TRYPTASE INHIBITORS | Aventis Pharmaceuticals Inc. (US) | 2003-04-02 | — | — | EP | disclosed |
| WO-2001090101-A1 | ARYLMETHYLAMINE DERIVATIVES FOR USE AS TRYPTASE INHIBITORS | AVENTIS PHARMACEUTICALS INC. (US) | 2001-11-29 | — | — | WO | disclosed |