Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR4 | Q13639 | 11/20 | 0.50 |
| ▸ | ACHE | P22303 | 9/20 | 0.50 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.48 |
| ▸ | NAMPT | P43490 | 1/20 | 0.48 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.48 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | HTR1D | P28221 | 1/20 | 0.48 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | HTR3A | P46098 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL13880931 | 0.94 | HTR4 (0.52) | HTR4HSD11B1CHRM4CHRM5ADRA2C | |
| SCHEMBL21230145 | 0.85 | PDE4A (0.47) | HTR4ACHENAMPTKMT2AALDH1A1 | |
| SCHEMBL18753954 | 0.83 | ALDH1A1 (0.50) | HTR4HSD11B1CHRM4CHRM5ADRA2C | |
| SCHEMBL15880929 | 0.83 | ALDH1A1 (0.59) | HSD11B1KMT2AALDH1A1POLBCYP2C19 | |
| SCHEMBL15649918 | 0.82 | ALDH1A1 (0.57) | HSD11B1KMT2AALDH1A1POLBCYP2C19 | |
| SCHEMBL13575486 | 0.82 | HPGD (0.63) | HSD11B1KMT2AALDH1A1POLBCYP2C19 | |
| SCHEMBL18753556 | 0.82 | ALDH1A1 (0.56) | HTR4HSD11B1CHRM4CHRM5ADRA2C | |
| SCHEMBL20750393 | 0.81 | KDM4E (0.40) | HTR4HSD11B1KMT2AALDH1A1 | |
| SCHEMBL1782181 | 0.80 | HPGD (0.64) | HSD11B1KMT2AALDH1A1POLBCYP2C19 | |
| SCHEMBL15651739 | 0.80 | HPGD (0.60) | HSD11B1KMT2AALDH1A1POLBCYP2C19 |
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-3241554-B1 | QUINOLINE-8-SULFONAMIDE DERIVATIVES HAVING AN ANTICANCER ACTIVITY | AGIOS PHARMACEUTICALS INC (US) | 2020-01-29 | — | — | EP | disclosed |
| EP-2448582-B1 | QUINOLINE-8-SULFONAMIDE DERIVATIVES HAVING AN ANTICANCER ACTIVITY | AGIOS PHARMACEUTICALS INC (US) | 2017-04-19 | — | — | EP | disclosed |