Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 1/20 | 0.42 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.42 |
| ▸ | GMNN | O75496 | 1/20 | 0.42 |
| ▸ | HTR3B | O95264 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MTOR | P42345 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.42 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14889131 | 1.00 | TPMT (0.42) | TPMTHTR3EGMNNHTR3BCYP1A2 | |
| SCHEMBL14889180 | 0.81 | ALDH1A1 (0.54) | CYP2D6ALOX15TSHRGAAALDH1A1 | |
| SCHEMBL11041995 | 0.80 | TPMT (0.56) | TPMTHTR3EGMNNHTR3BCYP1A2 | |
| SCHEMBL29117097 | 0.78 | CA12 (0.45) | CYP1A2ALDH1A1MAPTCA12CA1 | |
| SCHEMBL582408 | 0.73 | ALDH1A1 (0.53) | TSHRHSD17B10ALDH1A1MEN1KMT2A | |
| SCHEMBL588343 | 0.71 | ALDH1A1 (0.62) | TPMTHTR3EGMNNHTR3BCYP1A2 | |
| SCHEMBL2662880 | 0.71 | CA12 (0.62) | TPMTCYP1A2TSHRMEN1KMT2A | |
| SCHEMBL6672858 | 0.71 | TPMT (0.56) | TPMTHTR3EGMNNHTR3BCYP1A2 | |
| SCHEMBL8223280 | 0.70 | ADRB2 (0.53) | CYP1A2ALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL696766 | 0.70 | TPMT (0.47) | TPMTHTR3EGMNNHTR3BCYP1A2 |
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-102906064-B | The manufacture method of (1R, 2S)-1-amino-2-vinylcyclopropanecaracidlic acidlic ester that optical purity has been improved | KANEKA CORP. (JP) | 2015-07-29 | — | — | CN | disclosed |
| CN-102906064-A | Method for producing (1r, 2s)-1-amino-2-vinyl cyclopropane carboxylic acid ester that has improved optical purity | KANEKA CORP | 2013-01-30 | — | — | CN | disclosed |