Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 9/20 | 0.53 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21350744 | 0.87 | SLC22A12 (0.51) | SLC22A12KDM4ECYP2C9CYP1A2ALDH1A1 | |
| SCHEMBL21350618 | 0.86 | SLC22A12 (0.45) | SLC22A12KDM4ECYP2C9MAPTSMN1; SMN2 | |
| SCHEMBL21350742 | 0.86 | SLC22A12 (0.50) | SLC22A12KDM4ECYP2C9CYP1A2ALDH1A1 | |
| SCHEMBL28415846 | 0.86 | SLC22A12 (0.50) | SLC22A12KDM4ECYP2C9MAPTSMN1; SMN2 | |
| SCHEMBL28411824 | 0.85 | SLC22A12 (0.45) | SLC22A12NOTUMKDM4ECYP2C9MAPT | |
| SCHEMBL21350889 | 0.84 | SLC22A12 (0.70) | SLC22A12 | |
| SCHEMBL21331861 | 0.83 | SLC22A12 (0.60) | SLC22A12CYP2C9CYP1A2ALDH1A1 | |
| SCHEMBL21350523 | 0.81 | SLC22A12 (0.48) | SLC22A12KDM4ECYP2C9SMN1; SMN2ALDH1A1 | |
| SCHEMBL21331809 | 0.81 | SLC22A12 (0.74) | SLC22A12 | |
| SCHEMBL28417529 | 0.79 | SLC22A12 (0.48) | SLC22A12KDM4ECYP2C9CYP1A2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108440397-B | 3- (naphthalene-1-methyl substituted) pyridine derivative and synthesis method and application thereof | 南方医科大学 | 2020-06-05 | — | — | CN | disclosed |
| 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 |
| 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 |