Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | OGG1 | O15527 | 1/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL638306 | 0.87 | CYP1A2 (0.54) | KIF11CYP1A2CYP2D6KMT2AMAPT | |
| Hydrochloric Acid SCHEMBL27908053 | 0.85 | CYP1A2 (0.52) | KIF11CYP1A2CYP2D6KMT2AMAPT | |
| SCHEMBL28024028 | 0.85 | CYP1A2 (0.52) | KIF11CYP1A2CYP2D6KMT2AMAPT | |
| SCHEMBL4239216 | 0.83 | CA1 (0.45) | KIF11CYP1A2CYP2D6KMT2AMAPT | |
| SCHEMBL28012260 | 0.80 | ALDH1A1 (0.56) | KIF11CYP1A2CYP2D6MAOBKMT2A | |
| SCHEMBL2482093 | 0.80 | KIF11 (0.49) | KIF11CYP1A2CYP2D6KMT2AMAPT | |
| Hydrochloric Acid SCHEMBL27841052 | 0.78 | ALDH1A1 (0.54) | KIF11CYP1A2CYP2D6MAOBKMT2A | |
| SCHEMBL28012384 | 0.78 | HTT (0.47) | CYP1A2CYP2D6KMT2AMEN1ALDH1A1 | |
| SCHEMBL9076924 | 0.78 | CYP2C9 (0.64) | KIF11CYP1A2CYP2D6MAOAMAOB | |
| SCHEMBL9075795 | 0.78 | CYP2C9 (0.64) | KIF11CYP1A2CYP2D6MAOAMAOB |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7629140-B2 | Assay for cytochrome P450 isoform 2C9 | ISTITUTO DI RICHERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) | 2009-12-08 | — | — | US | claimed |
| US-20080193950-A1 | Rapid and sensitive; radiometric; automatic; multiwell plates; incubating with tritium-labeled diclofenac | MERCK SHARP & DOHME CORP. | 2008-08-14 | — | — | US | claimed |
| EP-1799843-A4 | ASSAY FOR CYTOCHROME P450 ISOFORM 2C9 | MERCK & CO INC (US) | 2008-04-09 | — | — | EP | claimed |
| EP-1799843-A2 | ASSAY FOR CYTOCHROME P450 ISOFORM 2C9 | Merck & Co., Inc. (US) | 2007-06-27 | — | — | EP | claimed |
| WO-2006041844-A2 | ASSAY FOR CYTOCHROME P450 ISOFORM 2C9 | MERCK & CO., INC. (US) | 2006-04-20 | — | — | WO | claimed |
| US-7629140-B2 | Assay for cytochrome P450 isoform 2C9 | ISTITUTO DI RICHERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) | 2009-12-08 | — | — | US | disclosed |
| US-20080193950-A1 | Rapid and sensitive; radiometric; automatic; multiwell plates; incubating with tritium-labeled diclofenac | MERCK SHARP & DOHME CORP. | 2008-08-14 | — | — | US | disclosed |
| EP-1799843-A4 | ASSAY FOR CYTOCHROME P450 ISOFORM 2C9 | MERCK & CO INC (US) | 2008-04-09 | — | — | EP | disclosed |
| EP-1799843-A2 | ASSAY FOR CYTOCHROME P450 ISOFORM 2C9 | Merck & Co., Inc. (US) | 2007-06-27 | — | — | EP | disclosed |
| WO-2006041844-A2 | ASSAY FOR CYTOCHROME P450 ISOFORM 2C9 | MERCK & CO., INC. (US) | 2006-04-20 | — | — | WO | disclosed |