Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | APAF1 | O14727 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.42 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | ACE | P12821 | 2/20 | 0.39 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19953490 | 0.89 | ACE (0.46) | CYP2C9CYP2C19MEN1APAF1ALDH1A1 | |
| SCHEMBL19953697 | 0.89 | ACE (0.46) | CYP2C9CYP2C19MEN1APAF1ALDH1A1 | |
| SCHEMBL19960921 | 0.83 | GRM7 (0.42) | CYP2C9CYP2C19MEN1APAF1ALDH1A1 | |
| SCHEMBL19960416 | 0.81 | GRM7 (0.60) | GRM7OPRM1OPRK1OPRL1PARP1 | |
| SCHEMBL19960674 | 0.78 | PARP1 (0.41) | CYP2C9ALDH1A1MAPTHPGDGRM7 | |
| SCHEMBL11472266 | 0.74 | GRIN1 (0.50) | PARP1ACEGRIN1GRIN2BSIGMAR1 | |
| SCHEMBL19960826 | 0.73 | ACE (0.47) | GRM7ACE | |
| SCHEMBL19953701 | 0.73 | ACE (0.47) | GRM7ACE | |
| SCHEMBL19953623 | 0.72 | L3MBTL1 (0.46) | MEN1ALDH1A1MAPTKMT2AGRM7 | |
| SCHEMBL19953612 | 0.72 | L3MBTL1 (0.46) | MEN1ALDH1A1MAPTKMT2AGRM7 |
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-2018047983-A1 | INDANE DERIVATIVES USEFUL AS MODULATORS OF MGLUR7 | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-03-15 | — | — | WO | disclosed |