Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.40 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | GALR3 | O60755 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18439 | 0.98 | EPHX1 (0.45) | EPHX1SMN1; SMN2ALDH1A1CHRM5CHRM1 | |
| SCHEMBL28720305 | 0.98 | EPHX1 (0.45) | EPHX1SMN1; SMN2ALDH1A1CHRM5CHRM1 | |
| SCHEMBL8896243 | 0.98 | EPHX1 (0.45) | EPHX1SMN1; SMN2ALDH1A1CHRM5CHRM1 | |
| Hydrochloric Acid SCHEMBL28284486 | 0.96 | EPHX1 (0.44) | EPHX1SMN1; SMN2ALDH1A1CHRM5CHRM1 | |
| SCHEMBL29153766 | 0.96 | ALDH1A1 (0.41) | EPHX1SMN1; SMN2ALDH1A1CHRM5CHRM1 | |
| SCHEMBL12506840 | 0.91 | — | — | |
| SCHEMBL13034075 | 0.88 | SMN1; SMN2 (0.54) | EPHX1SMN1; SMN2ALDH1A1NAAAFKBP1A | |
| SCHEMBL19842292 | 0.86 | SMN1; SMN2 (0.56) | EPHX1SMN1; SMN2ALDH1A1NAAAFKBP1A | |
| SCHEMBL6931991 | 0.86 | SMN1; SMN2 (0.56) | EPHX1SMN1; SMN2ALDH1A1NAAAFKBP1A | |
| SCHEMBL28379526 | 0.85 | SMN1; SMN2 (0.46) | EPHX1SMN1; SMN2ALDH1A1HPGDNAAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2448582-B1 | QUINOLINE-8-SULFONAMIDE DERIVATIVES HAVING AN ANTICANCER ACTIVITY | AGIOS PHARMACEUTICALS INC (US) | 2017-04-19 | — | — | EP | disclosed |
| US-5670563-A | ORGANOTIN COMPOUND, PHOSPHORUS COMPOUND | CIBA-SPECIALTY CHEMICALS CORPORATION (US) | 1997-09-23 | — | — | US | disclosed |
| CN-1022829-C | Synthesis of beta-lactams with metal compounds | UNIV UTRECHT (NL) | 1993-11-24 | — | — | CN | disclosed |
| CN-88100703-A | Synthesis of beta-lactams with metal compounds | — | 1988-08-17 | — | — | CN | disclosed |