Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VNN1 | O95497 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.33 |
| ▸ | P4HB | P07237 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8862529 | 0.79 | CYP1A2 (0.42) | VNN1CYP2C9NAMPTCYP1A2KDM4E | |
| SCHEMBL8863067 | 0.77 | VNN1 (0.37) | VNN1CYP2C9NAMPTCYP1A2KDM4E | |
| SCHEMBL3243595 | 0.76 | VNN1 (0.43) | VNN1CYP2C9NAMPTIDO1CYP1A2 | |
| SCHEMBL7823617 | 0.74 | VNN1 (0.46) | VNN1CYP2C9NAMPTIDO1CYP1A2 | |
| SCHEMBL7823614 | 0.74 | VNN1 (0.46) | VNN1CYP2C9NAMPTIDO1CYP1A2 | |
| SCHEMBL8866615 | 0.72 | BLM (0.45) | HIF1ASMN1; SMN2LMNA | |
| SCHEMBL9226679 | 0.70 | SMN1; SMN2 (0.43) | CYP1A2CYP2C19KDM4EMEN1KMT2A | |
| SCHEMBL9302445 | 0.69 | VNN1 (0.42) | VNN1CYP2C9NAMPTIDO1CYP1A2 | |
| SCHEMBL9302450 | 0.69 | VNN1 (0.42) | VNN1CYP2C9NAMPTIDO1CYP1A2 | |
| SCHEMBL9661857 | 0.68 | KCNA5 (0.44) | VNN1CYP2C9CYP1A2CYP2C19CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0612314-B1 | 2-PYRAZINYLETHYLAMINE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS | ASTRA AB (SE) | 1999-12-29 | — | — | EP | disclosed |
| US-5607935-A | 2-heterocyclicethylamine derivatives and their use as pharmaceuticals | FISONS CORPORATION (US) | 1997-03-04 | — | — | US | disclosed |
| EP-0540318-A1 | 2-Heterocyclicethylamine derivatives and their use as pharmaceuticals | FISONS CORPORATION (US) | 1993-05-05 | — | — | EP | disclosed |