Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 6/20 | 0.56 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1695603 | 1.00 | ABCG2 (0.56) | ABCG2AKR1C3LMNAKMT2AMEN1 | |
| SCHEMBL11026391 | 0.86 | ABCG2 (0.56) | ABCG2AKR1C3LMNAKMT2AMEN1 | |
| SCHEMBL25728780 | 0.84 | ABCG2 (0.57) | ABCG2AKR1C3LMNAKMT2AMEN1 | |
| SCHEMBL7672337 | 0.81 | ABCG2 (0.51) | ABCG2AKR1C3KMT2AMEN1RECQL | |
| SCHEMBL5698609 | 0.81 | MEN1 (0.42) | ABCG2AKR1C3LMNAKMT2AMEN1 | |
| SCHEMBL83065 | 0.81 | AKR1C3 (0.55) | ABCG2AKR1C3KMT2AMEN1RECQL | |
| SCHEMBL3818255 | 0.81 | AKR1C3 (0.55) | ABCG2AKR1C3KMT2AMEN1RECQL | |
| SCHEMBL9103420 | 0.81 | ABCG2 (0.54) | ABCG2AKR1C3KMT2AMEN1MAPT | |
| SCHEMBL3485765 | 0.81 | AKR1C3 (0.55) | ABCG2AKR1C3KMT2AMEN1RECQL | |
| SCHEMBL31439245 | 0.81 | MAPT (0.60) | ABCG2LMNAKMT2AMEN1MAPT |
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-2011138657-A1 | ARYL SUBSTITUTED OLEFINIC COMPOUNDS AS PDE10A INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2011-11-10 | — | — | WO | disclosed |