Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 5/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.34 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | KLK7 | P49862 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7733730 | 0.82 | KMT2A (0.42) | TSHRALDH1A1HTTKDM4EMEN1 | |
| SCHEMBL5950092 | 0.79 | TSHR (0.39) | GAATSHRALDH1A1HTTKDM4E | |
| SCHEMBL28483720 | 0.79 | TSHR (0.39) | GAATSHRALDH1A1HTTKDM4E | |
| SCHEMBL1337100 | 0.77 | TSHR (0.43) | GAATSHRALDH1A1HTTKDM4E | |
| SCHEMBL28367614 | 0.75 | TSHR (0.42) | GAATSHRALDH1A1HTTKDM4E | |
| SCHEMBL26631742 | 0.73 | ALDH1A1 (0.47) | GAATSHRALDH1A1TDP1KDM4E | |
| SCHEMBL31255240 | 0.73 | KDM4E (0.31) | GAAALDH1A1KDM4EMAPTAR | |
| SCHEMBL148781 | 0.72 | ALDH1A1 (0.55) | GAATSHRALDH1A1HTTKDM4E | |
| SCHEMBL6223613 | 0.71 | ALDH1A1 (0.43) | GAATSHRALDH1A1HTTTDP1 | |
| Iodide SCHEMBL31276096 | 0.70 | ALDH1A1 (0.53) | GAATSHRALDH1A1HTTKDM4E |
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-2008103353-A1 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | SYNTA PHARMACEUTICALS CORP. (US) | 2008-08-28 | — | — | WO | disclosed |