Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | IDH1 | O75874 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10185657 | 0.85 | IDH1 (0.47) | TSHRKMT2AHPGDMAPTIDH1 | |
| SCHEMBL10185674 | 0.85 | IDH1 (0.48) | KMT2AIDH1ALDH1A1OPRM1OPRK1 | |
| SCHEMBL10183299 | 0.83 | OPRM1 (0.40) | MAPTIDH1OPRM1OPRK1OPRL1 | |
| SCHEMBL10183337 | 0.82 | OPRM1 (0.39) | KMT2AMAPTIDH1OPRM1OPRK1 | |
| SCHEMBL10183319 | 0.82 | MEN1 (0.43) | KMT2AMAPTIDH1ALDH1A1OPRM1 | |
| SCHEMBL10183330 | 0.82 | IDH1 (0.48) | KMT2AMAPTIDH1ALDH1A1OPRM1 | |
| SCHEMBL10184102 | 0.82 | IDH1 (0.37) | KMT2AMAPTIDH1OPRM1OPRK1 | |
| SCHEMBL10183615 | 0.81 | RORC (0.36) | IDH1OPRM1OPRK1OPRL1 | |
| SCHEMBL10183782 | 0.80 | OPRM1 (0.40) | MAPTIDH1OPRM1OPRK1OPRL1 | |
| SCHEMBL10185644 | 0.80 | IDH1 (0.48) | KMT2AMAPTIDH1OPRM1OPRK1 |
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 |