Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 1/20 | 0.42 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
| ▸ | CCR2 | P41597 | 1/20 | 0.41 |
| ▸ | CHRNA1 | P02708 | 3/20 | 0.37 |
| ▸ | CHRNG | P07510 | 3/20 | 0.37 |
| ▸ | CHRNB1 | P11230 | 3/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.37 |
| ▸ | CHRND | Q07001 | 3/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21044527 | 0.86 | HCAR2 (0.42) | HCAR2CCR2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL21044455 | 0.84 | HCAR3 (0.33) | HCAR3HCAR2CCR2KMT2AMEN1 | |
| SCHEMBL21044503 | 0.77 | ALDH1A1 (0.36) | CCR2HSD11B1SMN1; SMN2 | |
| SCHEMBL21044558 | 0.76 | MMP2 (0.36) | — | |
| SCHEMBL21044512 | 0.75 | CA12 (0.41) | SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL21044493 | 0.75 | HCAR3 (0.38) | HCAR3HCAR2CCR2CHRNA1CHRNG | |
| SCHEMBL21044267 | 0.72 | HDAC4 (0.34) | CCR2 | |
| SCHEMBL21044387 | 0.72 | TDP1 (0.41) | PKMSMN1; SMN2KMT2AMEN1 | |
| SCHEMBL21044457 | 0.72 | CCR2 (0.40) | HCAR3HCAR2CCR2NOTUM | |
| SCHEMBL4574657 | 0.69 | ALDH1A1 (0.31) | SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3191451-B1 | 4-SUBSTITUTED PYRIDINE-2,6-DICARBOXYLIC ACID DERIVATIVES AND METHOD OF PREPARING SAME | OKINAWA INST SCIENCE & TECH SCHOOL CORP (JP) | 2019-06-05 | — | — | EP | claimed |