Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
| ▸ | MMP13 | P45452 | 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 | |
|---|---|---|---|---|
| SCHEMBL21176802 | 1.00 | NPC1 (0.47) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL21187133 | 0.85 | NPC1 (0.47) | NPC1RAB9ASMN1; SMN2MAPTKDM1A | |
| SCHEMBL21187140 | 0.85 | NPC1 (0.47) | NPC1RAB9ASMN1; SMN2MAPTKDM1A | |
| SCHEMBL21187128 | 0.85 | NPC1 (0.47) | NPC1RAB9ASMN1; SMN2MAPTKDM1A | |
| SCHEMBL21177092 | 0.84 | NPC1 (0.45) | NPC1RAB9ASMN1; SMN2MAPTHTT | |
| SCHEMBL21177091 | 0.84 | NPC1 (0.45) | NPC1RAB9ASMN1; SMN2MAPTHTT | |
| SCHEMBL17730084 | 0.75 | MEN1 (0.62) | RAB9AMAPTKDM1AALDH1A1LMNA | |
| SCHEMBL17730086 | 0.75 | MEN1 (0.62) | RAB9AMAPTKDM1AALDH1A1LMNA | |
| SCHEMBL24011345 | 0.71 | NPC1 (0.60) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL21187088 | 0.71 | IDO1 (0.50) | NPC1RAB9ASMN1; SMN2POLBMAPT |
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 |