Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 6/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 5/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.32 |
| ▸ | DDT | P30046 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.31 |
| ▸ | TUBB | P07437 | 1/20 | 0.31 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.31 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.31 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.31 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.31 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.31 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.31 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.31 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.31 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1378709 | 0.89 | MAPK14 (0.39) | MAPK14DDTBRAF | |
| SCHEMBL4781910 | 0.87 | GSK3A (0.33) | MAPK14NR1I2GSK3ADDTCYP1A2 | |
| SCHEMBL4955400 | 0.87 | BRAF (0.42) | MAPK14BRAF | |
| SCHEMBL4779949 | 0.86 | MAPK14 (0.37) | MAPK14NR1I2BRAF | |
| SCHEMBL4783136 | 0.84 | MAPK14 (0.39) | MAPK14GSK3ACYP2C9BRAF | |
| SCHEMBL4784135 | 0.84 | CYP1A2 (0.48) | NR1I2CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL4799754 | 0.83 | MAPK14 (0.37) | MAPK14NR1I2GSK3ADDT | |
| SCHEMBL4782660 | 0.83 | NR1I2 (0.42) | MAPK14NR1I2DDTBRAF | |
| SCHEMBL1378181 | 0.80 | BRAF (0.40) | NR1I2DDTBRAF | |
| SCHEMBL1380031 | 0.79 | TUBB4A (0.41) | NR1I2DDTTUBB4ATUBBTUBA3C |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008021388-A1 | HETEROARYL DERIVATIVES AS CYTOKINE INHIBITORS | KEMIA, INC. (US) | 2008-02-21 | — | — | WO | disclosed |