Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.38 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | ANPEP | P15144 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.36 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.36 |
| ▸ | DPP7 | Q9UHL4 | 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 | |
|---|---|---|---|---|
| SCHEMBL5966181 | 0.70 | CYP1A2 (0.46) | EPHX1TAAR1FFAR1FFAR4CYP1A2 | |
| SCHEMBL10716724 | 0.70 | DPP4 (0.49) | EPHX1SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL3289204 | 0.70 | DPP4 (0.49) | EPHX1SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL131351 | 0.70 | SLC6A2 (0.54) | EPHX1SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL3285405 | 0.68 | EPHX1 (0.50) | EPHX1SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL27837801 | 0.68 | EPHX1 (0.50) | EPHX1SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL3393241 | 0.68 | EPHX1 (0.50) | EPHX1SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL10890023 | 0.68 | EPHX1 (0.45) | EPHX1SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL28853816 | 0.68 | EPHX1 (0.45) | EPHX1SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL2800708 | 0.68 | ALDH1A1 (0.47) | EPHX1CYP1A2GRM5CYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105481699-B | A kind of method for synthesizing the propargylamine derivative for containing different substituents at alkynes end | 复旦大学 | 2017-12-01 | — | — | CN | disclosed |
| CN-105481699-A | Method for synthesizing propargylamine derivative with different substituent groups at alkyne terminal | UNIV FUDAN | 2016-04-13 | — | — | CN | disclosed |