Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 4/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.39 |
| ▸ | KCNK9 | Q9NPC2 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | FASN | P49327 | 1/20 | 0.39 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 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 | |
|---|---|---|---|---|
| SCHEMBL20002641 | 0.85 | TDP1 (0.42) | MEN1ALDH1A1TSHRKMT2APTPN1 | |
| SCHEMBL20003089 | 0.84 | GPR183 (0.45) | EPHX2MEN1ALDH1A1TSHRKMT2A | |
| SCHEMBL20002698 | 0.84 | HSD11B1 (0.47) | EPHX2MEN1ALDH1A1TSHRKMT2A | |
| SCHEMBL20002574 | 0.84 | ALDH1A1 (0.51) | EPHX2MEN1ALDH1A1TSHRKMT2A | |
| SCHEMBL20002705 | 0.84 | ALDH1A1 (0.41) | MEN1ALDH1A1TSHRKMT2APTPN1 | |
| SCHEMBL20002706 | 0.84 | HSD11B1 (0.47) | EPHX2MEN1ALDH1A1TSHRKMT2A | |
| SCHEMBL20002746 | 0.83 | CCR5 (0.44) | MEN1ALDH1A1TSHRKMT2APTPN1 | |
| SCHEMBL20002660 | 0.82 | FASN (0.52) | MEN1FASNTSHRKMT2APTPN1 | |
| SCHEMBL20003098 | 0.81 | GPR183 (0.38) | MEN1ALDH1A1TSHRKMT2APTPN1 | |
| SCHEMBL20002995 | 0.79 | GFER (0.50) | MEN1ALDH1A1TSHRKMT2A |
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 |