Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Phenylmethanesulfonic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRSS1 | P07477 | 3/20 | 0.49 |
| ▸ | PRSS2 | P07478 | 3/20 | 0.49 |
| ▸ | PRSS3 | P35030 | 3/20 | 0.49 |
| ▸ | F2 | P00734 | 2/20 | 0.49 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | MMP1 | P03956 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | MMP13 | P45452 | 1/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.47 |
| ▸ | ELANE | P08246 | 1/20 | 0.47 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.47 |
| ▸ | CA5A | P35218 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 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 | |
|---|---|---|---|---|
| Phenylmethanesulfonic Acid SCHEMBL28194151 | 0.87 | PRSS1 (0.54) | PRSS1PRSS2PRSS3F2CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL28294303 | 0.87 | CA2 (0.58) | PRSS1PRSS2PRSS3F2CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL30217949 | 0.87 | CA2 (0.58) | PRSS1PRSS2PRSS3F2CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL127384 | 0.87 | CA2 (0.58) | PRSS1PRSS2PRSS3F2CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL1749 | 0.87 | CA2 (0.58) | PRSS1PRSS2PRSS3F2CA1 | |
| SCHEMBL27839467 | 0.86 | PRSS1 (0.47) | PRSS1PRSS2PRSS3F2CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL28859050 | 0.85 | PRSS1 (0.52) | PRSS1PRSS2PRSS3F2CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL20543167 | 0.85 | CA2 (0.57) | PRSS1PRSS2PRSS3F2CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL16034407 | 0.85 | CA2 (0.56) | PRSS1PRSS2PRSS3F2CA1 | |
| Phenylmethanesulfonic Acid SCHEMBL9219268 | 0.85 | CA2 (0.56) | PRSS1PRSS2PRSS3F2CA1 |
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-1487955-B1 | AMMONIUM NITRILES AND THE USE THEREOF AS HYDROPHOBIC BLEACHING ACTIVATORS | CLARIANT PRODUKTE DEUTSCHLAND (DE) | 2008-05-21 | — | — | EP | claimed |
| EP-0035470-B1 | TEXTILE TREATING AGENT | CIBA-GEIGY AG (CH) | 1983-05-18 | — | — | EP | disclosed |