Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR2 | P50052 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MITF | O75030 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.34 |
| ▸ | IDH1 | O75874 | 7/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.32 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10183315 | 0.90 | AGTR2 (0.35) | AGTR2MEN1KMT2AIDH1ACHE | |
| SCHEMBL10183319 | 0.90 | MEN1 (0.43) | AGTR2MEN1KMT2AMITFALDH1A1 | |
| SCHEMBL10183311 | 0.84 | IDH1 (0.34) | AGTR2KMT2AALDH1A1NPC1IDH1 | |
| SCHEMBL10184010 | 0.83 | IDH1 (0.35) | AGTR2NPC1IDH1 | |
| SCHEMBL10185908 | 0.82 | IDH1 (0.35) | AGTR2ALDH1A1IDH1OPRM1 | |
| SCHEMBL10184031 | 0.82 | IDH1 (0.35) | AGTR2IDH1 | |
| SCHEMBL10183299 | 0.81 | OPRM1 (0.40) | AGTR2IDH1OPRM1LMNAHTT | |
| SCHEMBL10183337 | 0.80 | OPRM1 (0.39) | AGTR2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL10183782 | 0.78 | OPRM1 (0.40) | AGTR2IDH1OPRM1LMNA | |
| SCHEMBL10183654 | 0.78 | IDH1 (0.38) | AGTR2NPC1IDH1OPRM1LMNA |
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 |