Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.66 |
| ▸ | HTT | P42858 | 2/20 | 0.66 |
| ▸ | RXFP1 | Q9HBX9 | 5/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.63 |
| ▸ | AURKA | O14965 | 2/20 | 0.60 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.60 |
| ▸ | KDR | P35968 | 1/20 | 0.60 |
| ▸ | PRNP | P04156 | 3/20 | 0.58 |
| ▸ | PPARG | P37231 | 2/20 | 0.58 |
| ▸ | NR2E3 | Q9Y5X4 | 2/20 | 0.58 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | DHODH | Q02127 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL13136430 | 0.84 | ALDH1A1 (0.60) | ALDH1A1HTTRXFP1CYP1A2CYP2C9 | |
| SCHEMBL17593966 | 0.83 | DHODH (0.71) | ALDH1A1HTTRXFP1AURKAAURKB | |
| SCHEMBL1305487 | 0.83 | ALDH1A1 (0.85) | ALDH1A1HTTRXFP1CYP1A2CYP2C9 | |
| SCHEMBL28225220 | 0.82 | ALDH1A1 (0.57) | ALDH1A1HTTRXFP1CYP1A2CYP2C9 | |
| SCHEMBL15486910 | 0.81 | ALDH1A1 (0.71) | ALDH1A1HTTRXFP1CYP1A2CYP2C9 | |
| SCHEMBL14595374 | 0.79 | PDE10A (0.66) | HTTRXFP1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL15487148 | 0.77 | DHODH (0.56) | ALDH1A1HTTRXFP1CYP1A2CYP2C9 | |
| SCHEMBL31271707 | 0.76 | ALDH1A1 (0.64) | ALDH1A1HTTRXFP1AURKAAURKB | |
| SCHEMBL17593896 | 0.76 | PTGFR (0.65) | RXFP1AURKAAURKBKDRPRNP | |
| SCHEMBL15486934 | 0.75 | ALDH1A1 (0.56) | ALDH1A1HTTRXFP1CYP1A2CYP2C9 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7629468-B2 | Neuroprotectants, analgesics or anticonvulsants | JANSSEN PHARMACEUTICA NV (BE) | 2009-12-08 | — | — | US | disclosed |
| US-7629468-B2 | Neuroprotectants, analgesics or anticonvulsants | JANSSEN PHARMACEUTICA NV (BE) | 2009-12-08 | — | — | US | disclosed |
| US-7517517-B2 | Radiolabelled quinoline and quinolinone derivatives and their use as metabotropic glutamate receptor ligands | JANSSEN PHARMACEUTICA N.V. (BE) | 2009-04-14 | — | — | US | disclosed |
| US-7517517-B2 | Radiolabelled quinoline and quinolinone derivatives and their use as metabotropic glutamate receptor ligands | JANSSEN PHARMACEUTICA N.V. (BE) | 2009-04-14 | — | — | US | disclosed |
| WO-2003082350-A2 | RADIOLABELLED QUINOLINE AND QUINOLINONE DERIVATIVES AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR LIGANDS | JANSSEN PHARMACEUTICA N.V. (BE) | 2003-10-09 | — | — | WO | disclosed |