Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.58 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.58 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.58 |
| ▸ | CHEK2 | O96017 | 6/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | APEX1 | P27695 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL12967679 | 0.81 | HSP90AA1 (0.63) | TDP1HSP90AA1ESR2CHEK2GAA | |
| SCHEMBL6756159 | 0.76 | L3MBTL1 (0.57) | GAAHSD17B10SMN1; SMN2NPSR1TP53 | |
| SCHEMBL11564587 | 0.76 | CHEK2 (0.78) | TDP1HSP90AA1ESR2CHEK2NR4A2 | |
| SCHEMBL29924530 | 0.74 | TDP1 (1.00) | TDP1HSP90AA1ESR2CHEK2SMN1; SMN2 | |
| SCHEMBL1758956 | 0.74 | TDP1 (1.00) | TDP1HSP90AA1ESR2CHEK2SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7331913 | 0.73 | TDP1 (0.97) | TDP1HSP90AA1ESR2CHEK2SMN1; SMN2 | |
| SCHEMBL7316384 | 0.72 | ALDH1A1 (0.71) | TDP1GAASMN1; SMN2TP53ALDH1A1 | |
| Guanidine SCHEMBL8688480 | 0.72 | CHEK2 (0.69) | CHEK2NR4A2 | |
| SCHEMBL6376038 | 0.71 | GAA (0.43) | HSP90AA1GAAHSD17B10NPSR1ALDH1A1 | |
| SCHEMBL9305236 | 0.71 | HSP90AA1 (0.66) | TDP1HSP90AA1ESR2CHEK2SMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1019045-A4 | ANTITHROMBOTIC AGENTS | LILLY CO ELI (US) | 2002-07-03 | — | — | EP | disclosed |
| EP-1019045-A1 | ANTITHROMBOTIC AGENTS | ELI LILLY AND COMPANY (US) | 2000-07-19 | — | — | EP | disclosed |
| WO-1999000128-A1 | ANTITHROMBOTIC AGENTS | ELI LILLY AND COMPANY (US) | 1999-01-07 | — | — | WO | disclosed |