Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX1 | Q96LB2 | 2/20 | 0.74 |
| ▸ | PRSS1 | P07477 | 10/20 | 0.59 |
| ▸ | F2 | P00734 | 5/20 | 0.59 |
| ▸ | F10 | P00742 | 3/20 | 0.59 |
| ▸ | F7 | P08709 | 3/20 | 0.59 |
| ▸ | CA1 | P00915 | 2/20 | 0.57 |
| ▸ | CA2 | P00918 | 2/20 | 0.57 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.56 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.56 |
| ▸ | TMPRSS6 | Q8IU80 | 2/20 | 0.56 |
| ▸ | ST14 | Q9Y5Y6 | 2/20 | 0.56 |
| ▸ | KLK1 | P06870 | 2/20 | 0.55 |
| ▸ | KLK5 | Q9Y337 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | F12 | P00748 | 1/20 | 0.52 |
| ▸ | F3 | P13726 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL14259897 | 0.88 | PRSS1 (0.59) | MRGPRX1PRSS1F2F10F7 | |
| SCHEMBL1924100 | 0.80 | HTT (0.78) | CA1CA2HTTCA12CA9 | |
| SCHEMBL2742815 | 0.78 | CA1 (0.70) | CA1CA2HTTCA12CA9 | |
| SCHEMBL1446643 | 0.78 | CA1 (0.70) | CA1CA2HTTCA12CA9 | |
| SCHEMBL14259895 | 0.78 | PRSS1 (0.53) | MRGPRX1PRSS1F2F10F7 | |
| SCHEMBL28778912 | 0.77 | CA1 (0.64) | CA1CA2HTTCA12CA9 | |
| N-Benzylaniline SCHEMBL28146501 | 0.77 | FFAR1 (0.62) | CA1CA2HTTCA12CA9 | |
| SCHEMBL3875680 | 0.77 | PRSS1 (0.84) | PRSS1F2F10PRSS2PRSS3 | |
| SCHEMBL12348324 | 0.77 | PRSS1 (0.70) | PRSS1F2F10PRSS2PRSS3 | |
| SCHEMBL11882481 | 0.76 | CA1 (0.58) | MRGPRX1CA1CA2HTTCA12 |
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-5550159-A | Peptide mimics useful as platelet aggregation inhibitors | G. D. SEARLE & CO. (US) | 1996-08-27 | — | — | US | disclosed |
| US-5453440-A | Amidine functional group on benzene ring, anticoagulants | G. D. SEARLE & CO. (US) | 1995-09-26 | — | — | US | disclosed |
| WO-1993018058-A1 | PEPTIDES MIMICS USEFUL AS PLATELET AGGREGATION INHIBITORS | G.D. SEARLE & CO. (US) | 1993-09-16 | — | — | WO | disclosed |