Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 9/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.38 |
| ▸ | EP300 | Q09472 | 1/20 | 0.37 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21187095 | 0.87 | KMT2A (0.41) | KMT2APOLBMEN1TRPV1HTR1A | |
| SCHEMBL21187129 | 0.72 | RAB9A (0.49) | POLB | |
| SCHEMBL21187135 | 0.72 | EPHX2 (0.40) | KMT2APOLBMEN1TRPV1DPP4 | |
| SCHEMBL21187132 | 0.71 | MAOA (0.48) | KMT2A | |
| SCHEMBL21187119 | 0.71 | NPC1 (0.51) | KMT2APOLBMEN1 | |
| SCHEMBL21187195 | 0.71 | NPC1 (0.51) | KMT2APOLBMEN1 | |
| SCHEMBL21187163 | 0.68 | GRM5 (0.39) | TRPV1DPP4 | |
| SCHEMBL1515236 | 0.66 | HTR2C (0.47) | HDAC4 | |
| SCHEMBL29878889 | 0.66 | HTR2C (0.47) | HDAC4 | |
| SCHEMBL21187149 | 0.65 | NPC1 (0.46) | KMT2APOLBMEN1TRPV1 |
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 |