Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.43 |
| ▸ | FEN1 | P39748 | 1/20 | 0.43 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6647885 | 0.85 | SMN1; SMN2 (0.42) | KMT2ACYP1A2CYP2C19ERCC1FEN1 | |
| SCHEMBL5259936 | 0.85 | SMN1; SMN2 (0.47) | ERCC1FEN1ERCC4ALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL5255058 | 0.84 | SMN1; SMN2 (0.46) | ERCC1FEN1ERCC4ALDH1A1HPGD | |
| SCHEMBL6647317 | 0.82 | ALDH1A1 (0.44) | KMT2ACYP1A2CYP2C19ERCC1FEN1 | |
| SCHEMBL5129033 | 0.82 | ALDH1A1 (0.50) | KMT2ACYP1A2CYP2C19ERCC1FEN1 | |
| SCHEMBL5127722 | 0.82 | ALDH1A1 (0.46) | KMT2ACYP1A2CYP2C19ERCC1FEN1 | |
| SCHEMBL6648519 | 0.82 | KCNE1 (0.44) | KMT2AERCC1FEN1ERCC4ALDH1A1 | |
| SCHEMBL5127980 | 0.81 | CXCR4 (0.53) | KMT2ACYP1A2CYP2C19ERCC1FEN1 | |
| SCHEMBL5117167 | 0.81 | LMNA (0.49) | KMT2ACYP1A2CYP2C19ERCC1FEN1 | |
| SCHEMBL5128003 | 0.81 | ALDH1A1 (0.50) | KMT2AERCC1FEN1ERCC4ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1441734-A1 | DIHYDROXYPYRIMIDINE CARBOXAMIDE INHIBITORS OF HIV INTEGRASE | Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) | 2004-08-04 | — | — | EP | claimed |
| WO-2003035076-A1 | DIHYDROXYPYRIMIDINE CARBOXAMIDE INHIBITORS OF HIV INTEGRASE | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) | 2003-05-01 | — | — | WO | claimed |
| EP-1441734-A1 | DIHYDROXYPYRIMIDINE CARBOXAMIDE INHIBITORS OF HIV INTEGRASE | Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) | 2004-08-04 | — | — | EP | disclosed |
| WO-2003035076-A1 | DIHYDROXYPYRIMIDINE CARBOXAMIDE INHIBITORS OF HIV INTEGRASE | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) | 2003-05-01 | — | — | WO | disclosed |