Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.55 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13861254 | 0.95 | SIGMAR1 (0.56) | SIGMAR1EPHX1CNR2TDP1MEN1 | |
| SCHEMBL4422293 | 0.88 | SIGMAR1 (0.55) | SIGMAR1CNR2TDP1MEN1KMT2A | |
| SCHEMBL4180217 | 0.86 | SIGMAR1 (0.57) | SIGMAR1EPHX1TDP1MEN1KMT2A | |
| SCHEMBL13951311 | 0.86 | SIGMAR1 (0.49) | SIGMAR1EPHX1CNR2TDP1MEN1 | |
| SCHEMBL4434497 | 0.85 | SIGMAR1 (0.53) | SIGMAR1EPHX1TDP1MEN1KMT2A | |
| SCHEMBL2429327 | 0.85 | SIGMAR1 (0.56) | SIGMAR1EPHX1TDP1MEN1KMT2A | |
| SCHEMBL1328433 | 0.85 | CTSD (0.54) | SIGMAR1TDP1MEN1KMT2AALDH1A1 | |
| SCHEMBL10046336 | 0.85 | SIGMAR1 (0.53) | SIGMAR1EPHX1TDP1MEN1KMT2A | |
| SCHEMBL22859604 | 0.84 | KMT2A (0.49) | SIGMAR1EPHX1CNR2TDP1MEN1 | |
| SCHEMBL4472678 | 0.84 | TSHR (0.60) | SIGMAR1EPHX1MEN1KMT2AALDH1A1 |
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-2017131156-A1 | CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF | 東レ株式会社 | 2017-08-03 | — | — | WO | disclosed |