Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.58 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21043084 | 0.90 | NPC1 (0.47) | NPC1RAB9ANOD2ATMALDH1A1 | |
| SCHEMBL16628264 | 0.87 | CHRM1 (0.47) | NPC1RAB9ANOD2ATMKDM4E | |
| SCHEMBL16628334 | 0.87 | NPC1 (0.44) | NPC1RAB9ANOD2ATMKDM4E | |
| SCHEMBL19997523 | 0.85 | CHRM1 (0.48) | NPC1RAB9ANOD2ATMSMN1; SMN2 | |
| SCHEMBL16628263 | 0.81 | POLB (0.56) | ALDH1A1HTTSMN1; SMN2MAPTCHRM1 | |
| SCHEMBL22001368 | 0.81 | ALDH1A1 (0.66) | NPC1RAB9ANOD2ATMALDH1A1 | |
| SCHEMBL16593304 | 0.79 | NPC1 (0.47) | NPC1RAB9ANOD2ATMALDH1A1 | |
| SCHEMBL22001753 | 0.78 | POLB (0.53) | ALDH1A1HTTSMN1; SMN2MAPTCHRM1 | |
| SCHEMBL16628328 | 0.78 | RPS6KB1 (0.54) | ALDH1A1HTTSMN1; SMN2CHRM1AURKA | |
| SCHEMBL16628329 | 0.78 | CHRM1 (0.44) | CHRM1RPS6KB1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3489237-A1 | 4-AZAINDOLE DERIVATIVES | Eisai R&D Management Co., Ltd. (JP) | 2019-05-29 | — | — | EP | disclosed |
| WO-2015049574-A1 | 4-AZAINDOLE DERIVATIVES | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2015-04-09 | — | — | WO | disclosed |