Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.40 |
| ▸ | NQO1 | P15559 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | ACACA | Q13085 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.37 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18201981 | 0.85 | SMN1; SMN2 (0.46) | NQO1ALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL18201982 | 0.81 | LMNA (0.53) | PPARGPPARACNR2L3MBTL1SMN1; SMN2 | |
| SCHEMBL8699347 | 0.79 | THRB (0.39) | THRBACACBALDH1A1GPR84PPARG | |
| SCHEMBL7753262 | 0.78 | NQO1 (0.67) | THRBNQO1ACACBALDH1A1MAPT | |
| SCHEMBL25548946 | 0.76 | NQO1 (0.64) | THRBNQO1ACACBALDH1A1GPR84 | |
| SCHEMBL7347411 | 0.73 | THRB (0.47) | THRBACACBALDH1A1PPARGPPARA | |
| SCHEMBL10613369 | 0.72 | NQO1 (0.58) | THRBNQO1ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL17614864 | 0.72 | NQO1 (0.58) | THRBNQO1ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL18952990 | 0.72 | KMT2A (0.42) | THRBACACBALDH1A1PPARGPPARA | |
| SCHEMBL15330491 | 0.71 | NQO1 (0.56) | NQO1ACACBACACATDP1 |
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-2016176473-A1 | APELIN RECEPTOR AGONISTS AND METHODS OF USE THEREOF | SANFORD-BURNHAM MEDICAL RESEARC INSTITUTE (US) | 2016-11-03 | — | — | WO | disclosed |