Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | TRPM8 | Q7Z2W7 | 5/20 | 0.47 |
| ▸ | ACP3 | P15309 | 1/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | GLS | O94925 | 1/20 | 0.44 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.40 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.40 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.40 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.40 |
| ▸ | HTR3B | O95264 | 1/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.40 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5064611 | 1.00 | PARP1 (0.50) | PARP1TRPM8ACP3ADRA1DMEN1 | |
| SCHEMBL29973154 | 1.00 | PARP1 (0.50) | PARP1TRPM8ACP3ADRA1DMEN1 | |
| SCHEMBL6455240 | 1.00 | PARP1 (0.50) | PARP1TRPM8ACP3ADRA1DMEN1 | |
| SCHEMBL15774550 | 0.84 | PARP1 (0.53) | PARP1TRPM8ACP3ADRA1DMEN1 | |
| SCHEMBL1712936 | 0.82 | LMNA (0.59) | PARP1ACP3MEN1KMT2AGLS | |
| SCHEMBL606571 | 0.82 | LMNA (0.59) | PARP1ACP3MEN1KMT2AGLS | |
| SCHEMBL30147772 | 0.82 | LMNA (0.59) | PARP1ACP3MEN1KMT2AGLS | |
| SCHEMBL606570 | 0.82 | LMNA (0.59) | PARP1ACP3MEN1KMT2AGLS | |
| SCHEMBL7283486 | 0.81 | PARP1 (0.50) | PARP1TRPM8ACP3ADRA1DMEN1 | |
| SCHEMBL1353575 | 0.81 | PARP1 (0.50) | PARP1TRPM8ACP3ADRA1DMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080261286-A1 | Methods for producing optically active alpha-hydroxy amides | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2008-10-23 | — | — | US | disclosed |
| US-20050202545-A1 | Methods for producing optically active alpha-hydroxy amides | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2005-09-15 | — | — | US | disclosed |
| EP-0303545-A2 | Process for the preparation of phenylethanolaminotetralines | ELF SANOFI (FR) | 1989-02-15 | — | — | EP | disclosed |