Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | PTGDR2 | Q9Y5Y4 | 4/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | RPS6KB2 | Q9UBS0 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.40 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1395762 | 0.84 | MAPT (0.38) | TDP1KDM4EALDH1A1HPGDGAA | |
| SCHEMBL9195483 | 0.80 | CYP1A2 (0.51) | TDP1KDM4EALDH1A1CYP1A2RPS6KB2 | |
| SCHEMBL5538538 | 0.79 | CYP2A6 (0.34) | TDP1KDM4EALDH1A1HPGDGAA | |
| SCHEMBL5842368 | 0.76 | CYP2A6 (0.45) | TDP1KDM4EALDH1A1HPGDGAA | |
| SCHEMBL5320285 | 0.75 | SLC7A5 (0.50) | KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL9351582 | 0.75 | SLC7A5 (0.50) | KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL7140207 | 0.75 | GAA (0.38) | TDP1KDM4EALDH1A1HPGDGAA | |
| SCHEMBL22528248 | 0.74 | AKR1B1 (0.50) | TDP1KDM4EALDH1A1HPGDGAA | |
| SCHEMBL5323213 | 0.73 | KIF11 (0.42) | TDP1POLBKMT2A | |
| SCHEMBL2095050 | 0.72 | ALDH1A1 (0.35) | TDP1KDM4EALDH1A1HPGDHSD17B10 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5256661-A | Dopamiaergic agents; reducing intraocular pressure | WHITBY RESEARCH, INC. (US) | 1993-10-26 | — | — | US | disclosed |
| US-5177112-A | Glucoma, dopaminergic response | WHITBY RESEARCH, INC. (US) | 1993-01-05 | — | — | US | disclosed |
| EP-0254989-A2 | Substituted 2-Aminotetralins | Whitby Research Incorporated (US) | 1988-02-03 | — | — | EP | disclosed |
| EP-0048954-B1 | BETA-LACTAM COMPOUNDS, PROCESS FOR THE PREPARATION THEREOF AND INTERMEDIATE PRODUCTS FOR THE PREPARATION THEREOF | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 1986-12-30 | — | — | EP | disclosed |
| US-4346076-A | Bis-tetrazoylmethyl substituted cephalosporin antibiotics | ELI LILLY AND COMPANY (US) | 1982-08-24 | — | — | US | disclosed |
| EP-0048169-A2 | Bis-tetrazoylmethyl substituted cephalosporin antibiotics, their preparation and pharmaceutical formulations containing them | ELI LILLY AND COMPANY (US) | 1982-03-24 | — | — | EP | disclosed |
| EP-0002210-A1 | 6- and 6,6- disubstituted-2-substituted-pen-2-em-3-carboxylic acids; processes for their preparation and pharmaceutical compositions containing such compounds | MERCK & CO. INC. (US) | 1979-06-13 | — | — | EP | disclosed |