Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | MMP13 | P45452 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.41 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.41 |
| ▸ | STS | P08842 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 3/20 | 0.41 |
| ▸ | JAK1 | P23458 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4773698 | 0.93 | MEN1 (0.51) | MEN1KMT2AMMP13POLBALDH1A1 | |
| SCHEMBL20002628 | 0.88 | USP30 (0.45) | ALDH1A1GPR119PDE4BPTPN2PTPN1 | |
| SCHEMBL23203914 | 0.85 | USP2 (0.44) | MEN1KMT2AHDAC1HDAC2MMP13 | |
| SCHEMBL20002870 | 0.82 | PDK2 (0.38) | KMT2AALDH1A1 | |
| SCHEMBL14538368 | 0.81 | ALDH1A1 (0.48) | ALDH1A1GPR119PTPN2PTPN1PTPN6 | |
| SCHEMBL13229888 | 0.81 | STS (0.57) | MEN1KMT2AALDH1A1GPR119PTPN2 | |
| SCHEMBL15231313 | 0.81 | FPR2 (0.47) | ALDH1A1GPR119PTPN2PTPN1PTPN6 | |
| SCHEMBL21425682 | 0.80 | PDE4B (0.42) | MMP13POLBALDH1A1GPR119PDE4B | |
| SCHEMBL13947677 | 0.80 | GPR119 (0.57) | MEN1KMT2AGPR119PTPN2PTPN1 | |
| SCHEMBL20002931 | 0.80 | PDK2 (0.39) | POLBALDH1A1 |
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 |