Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | AKT1 | P31749 | 2/20 | 0.35 |
| ▸ | MMP8 | P22894 | 2/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.30 |
| ▸ | HTR3A | P46098 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.30 |
| ▸ | CDK9 | P50750 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30141445 | 0.80 | NAMPT (0.38) | NAMPTHTR2CAKT1MMP8MMP3 | |
| SCHEMBL28625656 | 0.78 | NAMPT (0.37) | NAMPTHTR2CAKT1MMP8MMP3 | |
| SCHEMBL10296103 | 0.68 | NAMPT (0.45) | NAMPTHTR2CAKT1HRH4HRH3 | |
| SCHEMBL11515494 | 0.68 | BAZ2B (0.43) | NAMPTHTR2CAKT1HRH4HRH3 | |
| Hydrochloric Acid SCHEMBL11517181 | 0.67 | HRH3 (0.39) | HRH3 | |
| SCHEMBL10361558 | 0.67 | PARP1 (0.33) | AKT1HRH4HRH3KMT2AALDH1A1 | |
| SCHEMBL17106486 | 0.67 | NAMPT (0.46) | NAMPT | |
| SCHEMBL29497557 | 0.67 | MAPT (0.32) | NAMPTMAPT | |
| SCHEMBL22916015 | 0.65 | POLB (0.57) | NAMPTHTR2CKMT2AMAPTALDH1A1 | |
| SCHEMBL6423555 | 0.65 | HRH4 (0.39) | NAMPTHTR2CHRH4HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115043844-A | TRK kinase inhibitor compounds and uses thereof | 河南迈英诺医药科技有限公司 | 2022-09-13 | — | — | CN | disclosed |