Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25225127 | 0.83 | HTT (0.47) | SIGMAR1L3MBTL1CYP2C19ALDH1A1KMT2A | |
| SCHEMBL5862047 | 0.81 | HTT (0.55) | L3MBTL1SMN1; SMN2ALDH1A1LMNAKMT2A | |
| Trifluoroacetic Acid SCHEMBL28658926 | 0.74 | HTT (0.47) | SIGMAR1SMN1; SMN2ALDH1A1MAPTEPHX2 | |
| SCHEMBL17033023 | 0.71 | MEN1 (0.53) | SIGMAR1ALDH1A1LMNAKMT2AMAPT | |
| SCHEMBL10118184 | 0.71 | PLK1 (0.53) | SIGMAR1SMN1; SMN2ALDH1A1LMNAKMT2A | |
| SCHEMBL18474437 | 0.70 | KHK (0.51) | SMN1; SMN2ALDH1A1LMNAMAPK1KMT2A | |
| SCHEMBL16582911 | 0.70 | AOC2 (0.54) | SIGMAR1SMN1; SMN2EPHX2NR1H4 | |
| SCHEMBL16509281 | 0.69 | KMT2A (0.37) | ALDH1A1KMT2AKDM4EMEN1OPRM1 | |
| SCHEMBL17033021 | 0.69 | RORC (0.52) | SIGMAR1L3MBTL1CYP2C19SMN1; SMN2ALDH1A1 | |
| SCHEMBL2407621 | 0.67 | SMN1; SMN2 (0.46) | SIGMAR1SMN1; SMN2ALDH1A1LMNAMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107205972-A | Substituted N- (2- (amino) -2-oxoethyl) benzamide inhibitors of autotaxin and their preparation and use in the treatment of LPA-dependent or LPA-mediated diseases | X-RX股份有限公司 | 2017-09-26 | — | — | CN | disclosed |