Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL18753448 | 0.89 | LMNA (0.51) | LMNAHTTALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL18753353 | 0.88 | HPGD (0.51) | LMNAHTTALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL18753487 | 0.87 | ALDH1A1 (0.54) | LMNAHTTALDH1A1KMT2AKDM4E | |
| SCHEMBL18753318 | 0.87 | KMT2A (0.59) | LMNAHTTALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL18753391 | 0.84 | ALDH1A1 (0.48) | LMNAHTTALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL18753349 | 0.84 | PKLR (0.41) | LMNAHTTALDH1A1KMT2AMEN1 | |
| SCHEMBL18753484 | 0.82 | MYC (0.54) | LMNAALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL18753307 | 0.81 | TSHR (0.47) | LMNAHTTALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL18753310 | 0.80 | ALDH1A1 (0.41) | LMNAHTTALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL18753852 | 0.79 | POLB (0.45) | ALDH1A1KMT2AMEN1TSHRABL1 |
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 |