Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 8/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 6/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 6/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 6/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 5/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | ASIC3 | Q9UHC3 | 2/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 4/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | CSF1R | P07333 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL15124655 | 0.81 | IDO1 (0.48) | IDO1ADRA2ACYP3A4CYP2D6CYP2C9 | |
| SCHEMBL16655881 | 0.78 | NISCH (0.48) | IDO1ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL21022697 | 0.75 | TSHR (0.65) | TSHRCYP1A2CYP2C19HTR7 | |
| SCHEMBL1908405 | 0.73 | IDO1 (0.58) | IDO1ADRA2AADRA2BCYP3A4 | |
| SCHEMBL21022696 | 0.73 | TSHR (0.62) | TSHRCYP1A2CYP2C19HTR7 | |
| SCHEMBL2146565 | 0.70 | KDM4E (0.52) | TSHRCYP3A4TP53CYP1A2 | |
| SCHEMBL30096949 | 0.69 | TSHR (0.43) | TSHR | |
| SCHEMBL7326951 | 0.69 | IDO1 (0.44) | IDO1CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL2732615 | 0.68 | TSHR (0.50) | TSHRCYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL2186547 | 0.67 | TSHR (0.59) | TSHRHTR7 |
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-3057951-A1 | METHYLENE LINKED QUINOLINYL MODULATORS OF ROR-GAMMA-T | Janssen Pharmaceutica N.V. (BE) | 2016-08-24 | — | — | EP | disclosed |
| WO-2015057205-A1 | METHYLENE LINKED QUINOLINYL MODULATORS OF ROR-GAMMA-T | JANSSEN PHARMACEUTICA NV (BE) | 2015-04-23 | — | — | WO | disclosed |