Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESRRA | P11474 | 1/20 | 0.38 |
| ▸ | ACKR3 | P25106 | 2/20 | 0.35 |
| ▸ | DDT | P30046 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MIF | P14174 | 1/20 | 0.35 |
| ▸ | SPR | P35270 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | P2RY12 | Q9H244 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4781668 | 0.88 | MIF (0.39) | ACKR3DDTMIFCYP2C9CNR2 | |
| SCHEMBL14293530 | 0.83 | ESRRA (0.40) | ESRRASPRCYP2C9CYP2C19CA1 | |
| SCHEMBL4782960 | 0.83 | CYP2C19 (0.46) | ESRRASPRCYP2C9CYP2C19CA1 | |
| SCHEMBL14292741 | 0.82 | MIF (0.38) | ESRRAACKR3DDTMIFCNR2 | |
| SCHEMBL4780603 | 0.79 | DRD2 (0.38) | ACKR3DDTMIFCYP2C19CNR2 | |
| SCHEMBL4782176 | 0.79 | BRAF (0.45) | LMNAMAPT | |
| SCHEMBL4784135 | 0.77 | CYP1A2 (0.48) | KMT2ACYP2C9CYP2C19 | |
| SCHEMBL4782660 | 0.76 | NR1I2 (0.42) | DDTMIF | |
| SCHEMBL4782271 | 0.76 | MAPK14 (0.39) | DDTCYP2C9CYP2C19 | |
| SCHEMBL4781910 | 0.75 | GSK3A (0.33) | DDTCYP2C9CYP2C19 |
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 |