Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CPB1 | P15086 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 3/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL1848336 | 0.85 | POLB (0.39) | ALDH1A1KDM4ELMNAHPGDHSD17B10 | |
| SCHEMBL500883 | 0.81 | TSHR (0.38) | ALDH1A1KDM4ELMNAPOLBMAPK14 | |
| SCHEMBL1851312 | 0.79 | USP2 (0.46) | PKMALDH1A1KDM4EUSP2POLB | |
| SCHEMBL3535555 | 0.71 | ALDH1A1 (0.60) | ALDH1A1USP2CYP19A1NPSR1 | |
| SCHEMBL21569713 | 0.67 | L3MBTL1 (0.66) | LMNAPOLBTP53HTT | |
| SCHEMBL501042 | 0.67 | PTGER1 (0.38) | ALDH1A1KDM4ELMNAPOLBCYP19A1 | |
| SCHEMBL500921 | 0.67 | ALDH1A1 (0.40) | ALDH1A1POLBTP53CYP19A1AKR1C3 | |
| SCHEMBL501322 | 0.65 | ACKR3 (0.39) | ALDH1A1KDM4ELMNAPOLBNPSR1 | |
| SCHEMBL21569721 | 0.65 | L3MBTL1 (0.55) | PKMKDM4EHPGDPOLBTP53 | |
| SCHEMBL501656 | 0.64 | CA12 (0.41) | ALDH1A1KDM4ELMNAHPGDPOLB |
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-2323737-A2 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | Synta Pharmaceuticals Corp. (US) | 2011-05-25 | — | — | EP | disclosed |