Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 6/20 | 0.36 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.34 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 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 | |
|---|---|---|---|---|
| SCHEMBL20002294 | 0.87 | PTPN11 (0.36) | RORCCCR5CACNA1BKMT2ADDB1 | |
| SCHEMBL20002879 | 0.83 | NPC1 (0.44) | CCR5KMT2AGRIN1GRIN2BNPC1 | |
| SCHEMBL20002297 | 0.82 | NOTUM (0.47) | RORCCCR5KMT2ANOTUMGRIN1 | |
| SCHEMBL20002936 | 0.82 | CCR5 (0.46) | CCR5KMT2AGRIN1GRIN2BDPP4 | |
| SCHEMBL20002407 | 0.82 | SMN1; SMN2 (0.41) | CCR5KMT2AGRIN1GRIN2BNPC1 | |
| SCHEMBL20003024 | 0.80 | NOTUM (0.44) | CCR5CACNA1BKMT2ANOTUMGRIN1 | |
| SCHEMBL20003154 | 0.78 | RORC (0.39) | RORCCCR5CACNA1BKMT2ANOTUM | |
| SCHEMBL20002823 | 0.77 | CCR5 (0.38) | CCR5KMT2ADDB1CRBNGRIN1 | |
| SCHEMBL20003191 | 0.76 | RORC (0.41) | RORCCCR5CACNA1BKMT2ANOTUM | |
| SCHEMBL4097076 | 0.73 | CCR5 (0.42) | CCR5CACNA1BKMT2ANOTUMDDB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3092229-B1 | PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS | BRISTOL MYERS SQUIBB CO (US) | 2018-03-28 | — | — | EP | disclosed |