Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACP1 | P24666 | 4/20 | 0.57 |
| ▸ | DHODH | Q02127 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.48 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.48 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.48 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.48 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | KMO | O15229 | 2/20 | 0.47 |
| ▸ | C1R | P00736 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL2402407 | 0.96 | ACP1 (0.54) | ACP1DHODHMEN1KMT2APDE10A | |
| SCHEMBL2404467 | 0.89 | MEN1 (0.66) | ACP1DHODHMEN1KMT2APDE10A | |
| SCHEMBL8620618 | 0.85 | ACP1 (0.50) | ACP1DHODHMEN1KMT2APDE10A | |
| SCHEMBL8614847 | 0.80 | ACP1 (0.48) | ACP1DHODHMEN1KMT2APDE10A | |
| SCHEMBL14529195 | 0.79 | ACP1 (0.64) | ACP1MEN1KMT2APDE10AKMO | |
| SCHEMBL14471492 | 0.79 | PARP1 (0.47) | ACP1PARP1KMOCYP1A2TSHR | |
| SCHEMBL5271308 | 0.77 | NCOA1 (0.55) | MEN1KMT2ANCOA1NCOA3KDM4E | |
| SCHEMBL10390275 | 0.77 | ACP1 (0.56) | ACP1DHODHMEN1KMT2APDE10A | |
| SCHEMBL29586433 | 0.77 | LMNA (0.76) | DHODHMEN1KMT2APDE10ANCOA1 | |
| SCHEMBL379807 | 0.77 | LMNA (0.76) | DHODHMEN1KMT2APDE10ANCOA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2549872-A1 | TRPV4 ANTAGONISTS | GlaxoSmithKline LLC (US) | 2013-01-30 | — | — | EP | disclosed |
| WO-2011119693-A1 | TRPV4 ANTAGONISTS | GLAXOSMITHKLINE LLC (US) | 2011-09-29 | — | — | WO | disclosed |
| WO-2011119701-A1 | TRPV4 ANTAGONISTS | GLAXOSMITHKLINE LLC (US) | 2011-09-29 | — | — | WO | disclosed |