Known targets — ChEMBL curated mechanism
CHRM1CHRM2CHRM3CHRM4CHRM5SLC6A2dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.54 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.51 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CNR2 | P34972 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PLA2G2C | Q5R387 | 1/20 | 0.41 |
| ▸ | ALB | P02768 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL514091 | 1.00 | NR1I2 (0.54) | NR1I2MCHR1DNM1CYP2C9LMNA | |
| SCHEMBL4464875 | 0.98 | NR1I2 (0.55) | NR1I2MCHR1DNM1CYP2C9LMNA | |
| SCHEMBL20573511 | 0.98 | NR1I2 (0.51) | NR1I2MCHR1DNM1CYP2C9LMNA | |
| SCHEMBL4457641 | 0.98 | NR1I2 (0.55) | NR1I2MCHR1DNM1CYP2C9LMNA | |
| SCHEMBL305721 | 0.95 | NR1I2 (0.50) | NR1I2MCHR1DNM1CYP2C9LMNA | |
| SCHEMBL27095079 | 0.92 | NR1I2 (0.56) | NR1I2MCHR1DNM1CYP2C9LMNA | |
| SCHEMBL8725761 | 0.90 | NR1I2 (0.54) | NR1I2MCHR1CYP2C9LMNACYP2C19 | |
| SCHEMBL9619203 | 0.89 | NR1I2 (0.51) | NR1I2MCHR1CYP2C9LMNACYP2C19 | |
| SCHEMBL14840201 | 0.87 | NR1I2 (0.54) | NR1I2MCHR1CYP2C9LMNACYP2C19 | |
| SCHEMBL27095074 | 0.87 | NR1I2 (0.54) | NR1I2MCHR1CYP2C9LMNACYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012013167-A2 | METHOD OF ELECTROSTATIC SPINNING OF POLYMER MELT | ELMARCO S.R.O, (CZ) | 2012-02-02 | — | — | WO | disclosed |