Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.34 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21187125 | 0.88 | IDO1 (0.50) | IDO1RAB9ASMN1; SMN2NPC1EPHX2 | |
| SCHEMBL21187094 | 0.81 | EPHX2 (0.41) | IDO1SMN1; SMN2HTTEPHX2SORT1 | |
| SCHEMBL21187116 | 0.75 | SMN1; SMN2 (0.39) | IDO1RAB9ASMN1; SMN2NPC1EPHX2 | |
| SCHEMBL21187192 | 0.72 | IDO1 (0.68) | IDO1EPHX2WNT3A | |
| SCHEMBL9277352 | 0.70 | IDO1 (0.50) | IDO1HTTKDM4E | |
| SCHEMBL21187138 | 0.68 | IDO1 (0.50) | IDO1RAB9ASMN1; SMN2NPC1EPHX2 | |
| SCHEMBL21187131 | 0.68 | IDO1 (0.50) | IDO1RAB9ASMN1; SMN2NPC1EPHX2 | |
| SCHEMBL23660437 | 0.66 | IDO1 (0.48) | IDO1 | |
| SCHEMBL22730013 | 0.66 | IDO1 (0.48) | IDO1 | |
| SCHEMBL22730012 | 0.66 | IDO1 (0.48) | IDO1 |
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-2019141095-A1 | AMIDINE AND GUANIDINE DERIVATIVE, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF | 四川科伦博泰生物医药股份有限公司 | 2019-07-25 | — | — | WO | disclosed |