Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLO1 | Q04760 | 1/20 | 0.48 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.40 |
| ▸ | ITGAV | P06756 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ACLY | P53396 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP8 | P22894 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6984823 | 0.80 | HTR6 (0.48) | GLO1ALDH1A1KDM4EKMT2ASRC | |
| SCHEMBL6981247 | 0.79 | PARP14 (0.44) | PARP14ALDH1A1KDM4EHPGDITGB3 | |
| SCHEMBL6981450 | 0.74 | AKT1 (0.52) | PARP14ALDH1A1KDM4EHPGDKMT2A | |
| SCHEMBL6984534 | 0.73 | MLNR (0.53) | KDM4EHPGDKMT2ACA1CA2 | |
| SCHEMBL6984749 | 0.73 | MLNR (0.50) | ALDH1A1KDM4EHPGDITGB3ITGAV | |
| SCHEMBL6983098 | 0.72 | HCRTR1 (0.43) | ALDH1A1KMT2AACLYPGR | |
| SCHEMBL379494 | 0.72 | SRC (0.47) | ALDH1A1KDM4EHPGDKMT2ASRC | |
| SCHEMBL6986762 | 0.72 | ALDH1A1 (0.53) | GLO1ALDH1A1KDM4EKMT2A | |
| SCHEMBL6985112 | 0.72 | ALDH1A1 (0.64) | ALDH1A1KDM4EKMT2ACA1CA2 | |
| SCHEMBL6985321 | 0.72 | ALDH1A1 (0.48) | ALDH1A1KDM4EHPGDKMT2ASRC |
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-0991624-B1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA (DE) | 2003-11-19 | — | — | EP | disclosed |
| EP-0991624-A1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | Boehringer Ingelheim Pharma KG (DE) | 2000-04-12 | — | — | EP | disclosed |
| WO-1999000371-A1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1999-01-07 | — | — | WO | disclosed |