Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.36 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL1074359 | 0.70 | NPSR1 (0.60) | ESR1ESR2KDM4EMAPTALDH1A1 | |
| SCHEMBL27979541 | 0.70 | TYMP (0.40) | KDM4EMAPTALDH1A1HPGDGAA | |
| SCHEMBL15431517 | 0.68 | CA2 (0.43) | ESR1ESR2KDM4EMAPTALDH1A1 | |
| SCHEMBL3278733 | 0.68 | ESR1 (0.62) | ESR1ESR2KDM4EMAPTPIM1 | |
| SCHEMBL28677769 | 0.67 | GPR84 (0.42) | KDM4EMAPTALDH1A1HPGDHSD17B10 | |
| SCHEMBL9736741 | 0.66 | WEE1 (0.43) | KDM4EMAPTTDP1CA2CA4 | |
| SCHEMBL3360427 | 0.63 | KDM4E (0.40) | KDM4EMAPTALDH1A1HPGDHSD17B10 | |
| Biphenyl SCHEMBL3763955 | 0.62 | ALDH1A1 (0.60) | ALDH1A1CA2CA4CA5AACP3 | |
| Biphenyl SCHEMBL3727875 | 0.62 | ALDH1A1 (0.60) | ALDH1A1CA2CA4CA5AACP3 | |
| Biphenyl SCHEMBL263925 | 0.62 | ALDH1A1 (0.60) | ALDH1A1CA2CA4CA5AACP3 |
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-0537008-B1 | Use of biphosphonates for the manufacture of a medicament for blocking neoplastic transformation of cells induced by ras oncogenes | SQUIBB & SONS INC (US) | 1995-10-25 | — | — | EP | disclosed |
| EP-0537008-A1 | Use of biphosphonates for the manufacture of a medicament for blocking neoplastic transformation of cells induced by ras oncogenes | E.R. SQUIBB & SONS, INC. (US) | 1993-04-14 | — | — | EP | disclosed |
| EP-0513760-A2 | Use of biphosphonate squalene synthetase inhibitors in pharmaceutical compositions useful in lowering cholesterol | E.R. SQUIBB & SONS, INC. (US) | 1992-11-19 | — | — | EP | disclosed |