Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 9/20 | 0.47 |
| ▸ | P2RX3 | P56373 | 3/20 | 0.36 |
| ▸ | P2RX2 | Q9UBL9 | 3/20 | 0.36 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | TTK | P33981 | 1/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.35 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.35 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.34 |
| ▸ | NPBWR1 | P48145 | 2/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL22959108 | 0.82 | RORC (0.47) | RORCP2RX3P2RX2THRBNPBWR1 | |
| SCHEMBL29527631 | 0.82 | RORC (0.53) | RORCP2RX3P2RX2THRBMAPT | |
| SCHEMBL22959151 | 0.82 | RORC (0.53) | RORCP2RX3P2RX2THRBMAPT | |
| SCHEMBL22959254 | 0.81 | RORC (0.51) | RORCP2RX3P2RX2THRB | |
| SCHEMBL29872245 | 0.81 | RORC (0.51) | RORCP2RX3P2RX2THRB | |
| SCHEMBL24449964 | 0.77 | RORC (0.46) | RORCP2RX3P2RX2THRBMAPT | |
| SCHEMBL24449957 | 0.77 | RORC (0.43) | RORCP2RX3P2RX2THRBMAPT | |
| SCHEMBL24449959 | 0.76 | RORC (0.41) | RORCP2RX3P2RX2THRBMAPT | |
| SCHEMBL30558158 | 0.76 | RORC (0.41) | RORCP2RX3P2RX2THRBMAPT | |
| SCHEMBL22959061 | 0.75 | RORC (0.51) | RORCTHRBMAPTCYP1A2CYP3A4 |
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-2021026179-A1 | AGONISTS OF ROR GAMMAt | BRISTOL-MYERS SQUIBB COMPANY (US) | 2021-02-11 | — | — | WO | disclosed |