Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 9/20 | 0.76 |
| ▸ | F10 | P00742 | 1/20 | 0.76 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.76 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.76 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.76 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.71 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.71 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.71 |
| ▸ | HTT | P42858 | 1/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.60 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.60 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.60 |
| ▸ | MEP1B | Q16820 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.50 |
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 SCHEMBL7517991 | 0.85 | F10 (0.98) | AKR1C3F10PRSS1PRSS2PRSS3 | |
| SCHEMBL6565074 | 0.83 | ALDH1A1 (0.64) | F10PRSS1PRSS2PRSS3KMT2A | |
| Hydrochloric Acid SCHEMBL6565204 | 0.82 | ALDH1A1 (0.62) | F10PRSS1PRSS2PRSS3KMT2A | |
| SCHEMBL26212220 | 0.80 | CYP2C19 (0.70) | AKR1C3MAPK1KMT2ATDP1HTT | |
| SCHEMBL18085906 | 0.80 | ALDH1A1 (0.68) | AKR1C3F10PRSS1PRSS2PRSS3 | |
| SCHEMBL27702846 | 0.78 | AKR1C3 (0.91) | AKR1C3MAPK1KMT2ATDP1HTT | |
| SCHEMBL30866646 | 0.78 | CYP2C19 (0.76) | AKR1C3PRSS1PRSS2PRSS3MAPK1 | |
| SCHEMBL13614830 | 0.78 | CYP2C19 (0.76) | AKR1C3PRSS1PRSS2PRSS3MAPK1 | |
| SCHEMBL10460339 | 0.78 | RAB9A (0.61) | F10PRSS1PRSS2PRSS3KMT2A | |
| SCHEMBL4908736 | 0.77 | LMNA (0.59) | AKR1C3F10PRSS1PRSS2PRSS3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1174421-A1 | 3-AMIDINOBENZENESULFONAMIDE DERIVATIVES, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES IN THE PRODUCTION THEREOF | Kissei Pharmaceutical Co., Ltd. (JP) | 2002-01-23 | — | — | EP | disclosed |