Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 7/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 7/20 | 0.42 |
| ▸ | PKN2 | Q16513 | 4/20 | 0.39 |
| ▸ | PKN1 | Q16512 | 3/20 | 0.39 |
| ▸ | MAPK13 | O15264 | 3/20 | 0.35 |
| ▸ | MAPK12 | P53778 | 3/20 | 0.35 |
| ▸ | MAPK11 | Q15759 | 3/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.35 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.33 |
| ▸ | CDC7 | O00311 | 2/20 | 0.33 |
| ▸ | NFATC1 | O95644 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.33 |
| ▸ | NCF1 | P14598 | 1/20 | 0.33 |
| ▸ | PLD1 | Q13393 | 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 | |
|---|---|---|---|---|
| SCHEMBL7748830 | 0.74 | NFATC1 (0.58) | MAPK13MAPK12MAPK11MAPK14NFATC1 | |
| SCHEMBL1502091 | 0.73 | CYP11B1 (0.62) | CYP11B1CYP11B2IDO1BRD9 | |
| SCHEMBL27550009 | 0.72 | CYP11B1 (0.56) | CYP11B1CYP11B2IDO1 | |
| SCHEMBL10989195 | 0.70 | IDO1 (0.46) | CYP11B1CYP11B2IDO1 | |
| SCHEMBL1501997 | 0.66 | IDO1 (0.51) | CYP11B1CYP11B2IDO1 | |
| Morpholine SCHEMBL6137775 | 0.65 | MEN1 (0.44) | TDP1ADRB2NCF1PLD1 | |
| SCHEMBL7076732 | 0.65 | CYP11B1 (0.43) | CYP11B1CYP11B2MAPK13MAPK12MAPK11 | |
| SCHEMBL593796 | 0.64 | CYP11B1 (0.58) | CYP11B1CYP11B2IDO1BRD9 | |
| SCHEMBL27984310 | 0.63 | CYP11B1 (0.51) | CYP11B1CYP11B2IDO1 | |
| SCHEMBL4593524 | 0.62 | MAPK13 (0.42) | CYP11B1CYP11B2MAPK13MAPK12MAPK11 |
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-0906099-A4 | A METHOD OF TREATING CANCER | MERCK & CO INC (US) | 2001-02-07 | — | — | EP | claimed |
| EP-0906099-A1 | A METHOD OF TREATING CANCER | Merck & Co., Inc. (US) | 1999-04-07 | — | — | EP | claimed |
| WO-1997036587-A1 | A METHOD OF TREATING CANCER | MERCK & CO., INC. (US) | 1997-10-09 | — | — | WO | claimed |