Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21187219 | 0.91 | CHRM4 (0.37) | KMT2ACHRM4L3MBTL1TDP1MEN1 | |
| SCHEMBL21187130 | 0.78 | SMN1; SMN2 (0.39) | KMT2AL3MBTL1TDP1MEN1THRB | |
| SCHEMBL21187136 | 0.77 | SMN1; SMN2 (0.40) | KMT2AL3MBTL1TDP1MEN1THRB | |
| SCHEMBL21187127 | 0.77 | THRB (0.38) | THRBEPHX2SMN1; SMN2CYP2C9NPC1 | |
| SCHEMBL21187193 | 0.77 | THRB (0.38) | THRBEPHX2SMN1; SMN2CYP2C9NPC1 | |
| SCHEMBL21187123 | 0.77 | THRB (0.38) | THRBEPHX2SMN1; SMN2CYP2C9NPC1 | |
| SCHEMBL21397172 | 0.69 | MAPT (0.55) | KMT2AL3MBTL1TDP1MEN1EPHX2 | |
| SCHEMBL21187213 | 0.68 | NPC1 (0.48) | KMT2AL3MBTL1MEN1EPHX2SMN1; SMN2 | |
| SCHEMBL22405862 | 0.66 | ALDH1A1 (0.43) | KMT2AL3MBTL1MEN1ALOX5SMN1; SMN2 | |
| SCHEMBL27316765 | 0.64 | CACNA1B (0.39) | L3MBTL1SMN1; SMN2MAPTNPC1RAB9A |
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 |