Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 6/20 | 0.49 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CCKAR | P32238 | 2/20 | 0.33 |
| ▸ | CCKBR | P32239 | 2/20 | 0.33 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10185644 | 0.88 | IDH1 (0.48) | IDH1OPRM1OPRK1OPRL1KMT2A | |
| SCHEMBL10183680 | 0.85 | IDH1 (0.39) | IDH1OPRM1OPRK1OPRL1MEN1 | |
| SCHEMBL10183615 | 0.85 | RORC (0.36) | IDH1RORCOPRM1OPRK1OPRL1 | |
| SCHEMBL10185921 | 0.85 | IDH1 (0.38) | IDH1RORCOPRM1OPRK1OPRL1 | |
| SCHEMBL10183299 | 0.84 | OPRM1 (0.40) | IDH1OPRM1OPRK1OPRL1CCKAR | |
| SCHEMBL10183337 | 0.83 | OPRM1 (0.39) | IDH1OPRM1OPRK1OPRL1MEN1 | |
| SCHEMBL10183319 | 0.83 | MEN1 (0.43) | IDH1OPRM1OPRK1OPRL1ALDH1A1 | |
| SCHEMBL10184102 | 0.83 | IDH1 (0.37) | IDH1OPRM1OPRK1OPRL1MEN1 | |
| SCHEMBL10183782 | 0.83 | OPRM1 (0.40) | IDH1OPRM1OPRK1OPRL1CCKAR | |
| SCHEMBL10183290 | 0.82 | IDH1 (0.50) | IDH1HDAC1HDAC8HDAC6NPC1 |
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 |