Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10726634 | 0.74 | ALDH1A1 (0.53) | ALDH1A1CYP3A4TDP1TSHRMAPK1 | |
| SCHEMBL18484543 | 0.73 | SMN1; SMN2 (0.49) | ALDH1A1CYP3A4TDP1TSHRL3MBTL1 | |
| SCHEMBL18447913 | 0.72 | LMNA (0.43) | SMN1; SMN2LMNAHTTRAB9AHIF1A | |
| SCHEMBL18448785 | 0.71 | KCNH2 (0.41) | ALDH1A1CYP3A4TDP1MAPK1PDE3B | |
| SCHEMBL7567323 | 0.70 | LMNA (0.33) | ALDH1A1CYP3A4TDP1TSHRL3MBTL1 | |
| SCHEMBL18448354 | 0.70 | ACHE (0.56) | ALDH1A1CYP3A4TDP1TSHRL3MBTL1 | |
| SCHEMBL19205656 | 0.68 | EGFR (0.40) | ALDH1A1CYP3A4TDP1PDE3BPDE3A | |
| SCHEMBL19205814 | 0.68 | EGFR (0.40) | ALDH1A1CYP3A4TDP1PDE3BPDE3A | |
| SCHEMBL19205658 | 0.68 | EGFR (0.40) | ALDH1A1CYP3A4TDP1PDE3BPDE3A | |
| SCHEMBL18449598 | 0.67 | CYP3A4 (0.61) | ALDH1A1CYP3A4TDP1TSHRPDE3B |
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 |
|---|---|---|---|---|---|---|---|
| EP-3686187-A1 | PROCESS FOR THE PREPARATION OF ROR GAMMA MODULATORS | Glenmark Pharmaceuticals S.A. (CH) | 2020-07-29 | — | — | EP | disclosed |