Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 13/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | SLC22A11 | Q9NSA0 | 1/20 | 0.38 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.36 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL21333884 | 0.88 | SLC22A12 (0.53) | SLC22A12CYP3A4CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL21331848 | 0.81 | SLC22A12 (0.48) | SLC22A12CYP3A4CYP2C9TDP1PTGDR2 | |
| SCHEMBL21331861 | 0.81 | SLC22A12 (0.60) | SLC22A12CYP3A4CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL21350641 | 0.78 | CYP4F2 (0.47) | SLC22A12CYP3A4CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL21331811 | 0.77 | SLC22A12 (0.55) | SLC22A12CYP3A4CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL21350526 | 0.77 | SLC22A12 (0.68) | SLC22A12SLC22A11 | |
| SCHEMBL21331805 | 0.77 | SLC22A12 (0.44) | SLC22A12CYP3A4CYP2C9KDM4C | |
| SCHEMBL21331851 | 0.77 | SLC22A12 (0.44) | SLC22A12CYP3A4CYP2C9CYP2C19KDM4C | |
| SCHEMBL21331844 | 0.77 | SLC22A12 (0.46) | SLC22A12CYP3A4CYP2C9KDM4C | |
| SCHEMBL28414576 | 0.77 | SLC22A12 (0.46) | SLC22A12CYP3A4CYP2C9CYP2C19KDM4C |
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-2019169890-A1 | 3-(NAPHTHALENE-1-METHYL SUBSTITUTED)PYRIDINE DERIVATIVE, SYNTHETIC METHOD THEREFOR AND USE THEREOF | 南方医科大学 | 2019-09-12 | — | — | WO | disclosed |