Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | ACACB | O00763 | 6/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | PPARA | Q07869 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.43 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13241453 | 0.80 | SMN1; SMN2 (0.56) | GLASMN1; SMN2ATMPPARGPPARA | |
| SCHEMBL4427148 | 0.75 | GLA (0.49) | GLASMN1; SMN2ATM | |
| SCHEMBL3068206 | 0.75 | THRB (0.58) | SMN1; SMN2 | |
| SCHEMBL2563160 | 0.75 | NPC1 (0.55) | SMN1; SMN2ATM | |
| SCHEMBL11145058 | 0.74 | RARB (0.55) | SMN1; SMN2 | |
| SCHEMBL17301237 | 0.74 | MAPT (0.47) | GLASMN1; SMN2ATM | |
| SCHEMBL9177318 | 0.74 | SIGMAR1 (0.62) | GLASMN1; SMN2 | |
| SCHEMBL2748823 | 0.74 | CA1 (0.49) | — | |
| SCHEMBL17355769 | 0.73 | KDM4E (0.46) | SMN1; SMN2TAS1R3TAS1R1 | |
| SCHEMBL9905375 | 0.73 | NCEH1 (0.40) | SMN1; SMN2PPARATAS1R3TAS1R1 |
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-2509954-A1 | 4 -OXO- 1H -QUINOLINE- 3 - CARBOXAMIDES AS MODULATORS OF ATP -BINDING CASSETTE TRANSPORTERS | Vertex Pharmaceuticals Incorporated (US) | 2012-10-17 | — | — | EP | disclosed |
| WO-2011072241-A1 | 4 -OXO- IH -QUINOLINE- 3 - CARBOXAMIDES AS MODULATORS OF ATP -BINDING CASSETTE TRANSPORTERS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-06-16 | — | — | WO | disclosed |