Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTAFR | P25105 | 2/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | IDH1 | O75874 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.37 |
| ▸ | OGFRL1 | Q5TC84 | 2/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10184173 | 0.83 | OPRM1 (0.37) | IDH1OPRM1OPRK1OPRL1 | |
| SCHEMBL10184165 | 0.83 | IDH1 (0.52) | PTAFRHRH3ALDH1A1PKMSMN1; SMN2 | |
| SCHEMBL10183929 | 0.80 | CHRM2 (0.43) | ALDH1A1OPRM1OPRK1MAPTOPRL1 | |
| SCHEMBL10183722 | 0.79 | TP53 (0.41) | ALDH1A1SMN1; SMN2LMNAHTTOPRM1 | |
| SCHEMBL10185542 | 0.79 | LMNA (0.39) | PTAFRHRH3ALDH1A1PKMSMN1; SMN2 | |
| SCHEMBL10183670 | 0.78 | TRPM8 (0.41) | OPRM1OPRK1OPRD1OPRL1POLB | |
| SCHEMBL10183271 | 0.76 | MAPT (0.42) | ALDH1A1PKMSMN1; SMN2LMNAOPRM1 | |
| SCHEMBL10185835 | 0.73 | TSHR (0.38) | HRH3ALDH1A1SMN1; SMN2LMNAHTT | |
| SCHEMBL10185987 | 0.68 | IDH1 (0.42) | SMN1; SMN2IDH1OPRM1OPRK1OPRL1 | |
| SCHEMBL10185830 | 0.68 | IDH1 (0.71) | LMNAHTTIDH1MAPT |
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-2012009678-A1 | THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHOD OF USE | AGIOS PHARMACEUTICALS, INC. (US) | 2012-01-19 | — | — | WO | disclosed |