Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT2 | P31751 | 2/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | TYMP | P19971 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | ALPL | P05186 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | TTK | P33981 | 1/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1012506 | 0.79 | AKT2 (0.47) | AKT2CHEK1CYP1A2KMT2AMAPK1 | |
| SCHEMBL31499240 | 0.76 | AKT2 (0.40) | AKT2CHEK1KMT2AMAPK1NPSR1 | |
| SCHEMBL6209997 | 0.76 | AKT2 (0.66) | AKT2CHEK1CYP1A2CYP2C19KMT2A | |
| SCHEMBL31503309 | 0.68 | POLB (0.38) | CYP1A2CYP2C19KMT2AMAPK1L3MBTL1 | |
| SCHEMBL5504893 | 0.68 | KDM4E (0.58) | AKT2CYP1A2KMT2AMAPK1NPSR1 | |
| SCHEMBL11832268 | 0.68 | HPGD (0.36) | HPGD | |
| SCHEMBL28329373 | 0.67 | GRM5 (0.54) | AKT2CHEK1KMT2ANPSR1L3MBTL1 | |
| SCHEMBL2616447 | 0.66 | KDM4E (0.52) | CHEK1CYP1A2ALDH1A1KDM4EHPGD | |
| SCHEMBL18704565 | 0.66 | CDK5 (0.46) | AKT2CHEK1CYP1A2KMT2AMAPK1 | |
| SCHEMBL7560776 | 0.64 | AKT2 (0.59) | AKT2CHEK1KMT2AL3MBTL1GRM5 |
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-1554272-A1 | BENZIMIDAZOLES AND BENZOTHIAZOLES AS INHIBITORS OF MAP KINASE | ELI LILLY AND COMPANY (US) | 2005-07-20 | — | — | EP | disclosed |
| WO-2004014900-A1 | BENZIMIDAZOLES AND BENZOTHIAZOLES AS INHIBITORS OF MAP KINASE | ELI LILLY AND COMPANY (US) | 2004-02-19 | — | — | WO | disclosed |