Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.40 |
| ▸ | FEN1 | P39748 | 1/20 | 0.40 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL6647080 | 0.87 | SMN1; SMN2 (0.46) | ALDH1A1HPGDSMN1; SMN2POLBERCC1 | |
| Hydrochloric Acid SCHEMBL6649005 | 0.86 | SMN1; SMN2 (0.45) | ALDH1A1HPGDSMN1; SMN2POLBERCC1 | |
| SCHEMBL6649400 | 0.84 | SMN1; SMN2 (0.43) | ALDH1A1HPGDSMN1; SMN2POLBERCC1 | |
| SCHEMBL6647317 | 0.84 | ALDH1A1 (0.44) | KMT2AALDH1A1KDM4ELMNAHPGD | |
| SCHEMBL6644869 | 0.83 | SMN1; SMN2 (0.44) | KMT2AALDH1A1HPGDSMN1; SMN2POLB | |
| SCHEMBL2206077 | 0.83 | TMEM97 (0.50) | KMT2AMEN1ALDH1A1KDM4ELMNA | |
| SCHEMBL6647885 | 0.83 | SMN1; SMN2 (0.42) | KMT2AALDH1A1KDM4ELMNAHPGD | |
| SCHEMBL5113424 | 0.81 | ERCC1 (0.46) | ALDH1A1LMNASMN1; SMN2POLBERCC1 | |
| SCHEMBL5115149 | 0.81 | ALDH1A1 (0.41) | KMT2AMEN1ALDH1A1KDM4ELMNA | |
| SCHEMBL5259936 | 0.81 | SMN1; SMN2 (0.47) | ALDH1A1HPGDSMN1; SMN2POLBERCC1 |
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 2 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 | 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 |