Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CCR2 | P41597 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL21187183 | 0.84 | RAB9A (0.46) | RAB9ANPC1SMN1; SMN2GAAPOLB | |
| SCHEMBL21187143 | 0.84 | RAB9A (0.46) | RAB9ANPC1SMN1; SMN2GAAPOLB | |
| SCHEMBL21187132 | 0.84 | MAOA (0.48) | RAB9ANPC1SMN1; SMN2GAAALDH1A1 | |
| SCHEMBL21176909 | 0.81 | RAB9A (0.46) | RAB9ANPC1SMN1; SMN2GAAPOLB | |
| SCHEMBL21176908 | 0.81 | RAB9A (0.46) | RAB9ANPC1SMN1; SMN2GAAPOLB | |
| SCHEMBL21187199 | 0.74 | FPR1 (0.47) | RAB9ANPC1SMN1; SMN2ALDH1A1L3MBTL1 | |
| SCHEMBL21187195 | 0.74 | NPC1 (0.51) | RAB9ANPC1SMN1; SMN2POLBALDH1A1 | |
| SCHEMBL21187119 | 0.74 | NPC1 (0.51) | RAB9ANPC1SMN1; SMN2POLBALDH1A1 | |
| SCHEMBL21187165 | 0.72 | KMT2A (0.42) | POLB | |
| SCHEMBL21187134 | 0.72 | NPC1 (0.48) | RAB9ANPC1SMN1; SMN2ALDH1A1L3MBTL1 |
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 |