Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TXNRD1 | Q16881 | 4/20 | 0.49 |
| ▸ | GSR | P00390 | 1/20 | 0.49 |
| ▸ | DTYMK | P23919 | 1/20 | 0.47 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 3/20 | 0.45 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.44 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.43 |
| ▸ | THRA | P10827 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9658492 | 0.83 | DTYMK (0.51) | DTYMKVCAM1GAACA2POLB | |
| SCHEMBL11311354 | 0.83 | S1PR3 (0.45) | TXNRD1GSRVCAM1THRBS1PR3 | |
| SCHEMBL10347259 | 0.80 | KAT8 (0.61) | THRBS1PR3THRACA2 | |
| SCHEMBL1129732 | 0.80 | KAT8 (0.61) | THRBS1PR3THRACA2 | |
| SCHEMBL8962184 | 0.79 | THRB (0.48) | THRBS1PR3THRACA2POLB | |
| SCHEMBL11440376 | 0.79 | S1PR3 (0.42) | TXNRD1GSRTHRBS1PR3THRA | |
| SCHEMBL11158183 | 0.78 | KAT8 (0.55) | DTYMKHCAR3GAAMAPTAKR1C2 | |
| SCHEMBL11439912 | 0.78 | THRB (0.50) | TXNRD1GSRVCAM1THRB | |
| SCHEMBL20503359 | 0.77 | RARB (0.56) | THRBS1PR3THRA | |
| SCHEMBL10673351 | 0.77 | PPARA (0.61) | THRBS1PR3THRA |
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 |
|---|---|---|---|---|---|---|---|
| US-5726305-A | Substituted quinoline-2-carboxamides, their preparation and their use as pharmaceuticals, and intermediates | HOECHST AKTIENGESELLSCHAFT (DE) | 1998-03-10 | — | — | US | disclosed |
| US-5719164-A | Substituted quinoline-2-carboxamides, their preparation and their use as pharmaceuticals, and intermediates | HOECHST AKTIENGESELLSCHAFT (DE) | 1998-02-17 | — | — | US | disclosed |