Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.57 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MC4R | P32245 | 2/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PLAAT3 | P53816 | 2/20 | 0.40 |
| ▸ | PLAAT5 | Q96KN8 | 2/20 | 0.40 |
| ▸ | PLAAT2 | Q9NWW9 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3348194 | 0.89 | KCNH2 (0.63) | KCNH2TAAR1POLBMC4RGAA | |
| SCHEMBL3348171 | 0.88 | TAAR1 (0.53) | KCNH2TAAR1ALDH1A1GLATP53 | |
| SCHEMBL3346356 | 0.86 | KCNH2 (0.57) | KCNH2TAAR1ALDH1A1GLATP53 | |
| SCHEMBL3415193 | 0.84 | KCNH2 (0.65) | KCNH2TAAR1POLBMC4RPLAAT3 | |
| SCHEMBL3346386 | 0.82 | TAAR1 (0.48) | KCNH2TAAR1ALDH1A1GLATP53 | |
| SCHEMBL3353112 | 0.80 | MC4R (0.43) | KCNH2TAAR1ALDH1A1GLATP53 | |
| SCHEMBL3345900 | 0.80 | KCNH2 (0.58) | KCNH2MC4RTRPV1KDM4ELMNA | |
| SCHEMBL3350867 | 0.79 | KCNH2 (0.52) | KCNH2TRPV1 | |
| SCHEMBL3350808 | 0.79 | TAAR1 (0.53) | TAAR1ALDH1A1GLATP53POLB | |
| SCHEMBL3410485 | 0.79 | MC4R (0.43) | KCNH2TAAR1ALDH1A1GLATP53 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010059922-A1 | PYRROLIDINE CARBOXAMIDE COMPOUNDS | LIGAND PHARMACEUTICALS INCORPORATED (US) | 2010-05-27 | — | — | WO | claimed |