Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | PER2 | O15055 | 1/20 | 0.34 |
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 SCHEMBL8144666 | 0.95 | MAPK1 (0.41) | L3MBTL1HRH3MAPK1KMT2ATSHR | |
| SCHEMBL248961 | 0.79 | KDM4E (0.48) | HRH3TSHRCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL20576177 | 0.70 | L3MBTL1 (0.64) | L3MBTL1HRH3ACHEACACBGRM2 | |
| SCHEMBL249557 | 0.70 | CYP2A13 (0.50) | HRH3KMT2ACYP2C9KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL12494160 | 0.69 | L3MBTL1 (0.55) | L3MBTL1HRH3MAPK1KMT2AACHE | |
| SCHEMBL6737403 | 0.68 | CYP3A4 (0.43) | KMT2ATSHRCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL14537170 | 0.68 | MAPK1 (0.56) | L3MBTL1HRH3MAPK1KMT2ATSHR | |
| SCHEMBL2222171 | 0.68 | L3MBTL1 (0.65) | L3MBTL1HRH3MAPK1KMT2AACHE | |
| SCHEMBL2223756 | 0.67 | L3MBTL1 (0.70) | L3MBTL1HRH3MAPK1KMT2ACYP1A2 | |
| SCHEMBL20505562 | 0.67 | ACACB (0.60) | L3MBTL1HRH3CYP1A2CYP2C9ACACB |
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-0853618-A4 | SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS | RHONE POULENC RORER PHARMA (US) | 2000-03-15 | — | — | EP | disclosed |
| EP-0853618-A1 | SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS | RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) | 1998-07-22 | — | — | EP | disclosed |