Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Dipyridyl. 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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.86 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.86 |
| ▸ | LMNA | P02545 | 2/20 | 0.86 |
| ▸ | METAP2 | P50579 | 2/20 | 0.58 |
| ▸ | METAP1 | P53582 | 2/20 | 0.58 |
| ▸ | MMP2 | P08253 | 1/20 | 0.58 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | COMT | P21964 | 1/20 | 0.58 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.58 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 1/20 | 0.50 |
| ▸ | CA6 | P23280 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Oxyquinoline SCHEMBL891989 | 0.93 | ALDH1A1 (1.00) | ALDH1A1ALOX12LMNAMETAP2METAP1 | |
| Oxyquinoline SCHEMBL4456594 | 0.93 | ALDH1A1 (1.00) | ALDH1A1ALOX12LMNAMETAP2METAP1 | |
| Dipyridyl SCHEMBL8817654 | 0.87 | KDM4E (0.67) | ALDH1A1ALOX12LMNAMETAP1TSHR | |
| Dipyridyl SCHEMBL9615229 | 0.87 | TSHR (0.78) | ALDH1A1ALOX12LMNAMETAP2METAP1 | |
| Phenanthroline SCHEMBL29020755 | 0.85 | ALDH1A1 (0.85) | ALDH1A1ALOX12LMNAMETAP2METAP1 | |
| Oxyquinoline SCHEMBL29729555 | 0.82 | ALDH1A1 (0.74) | ALDH1A1ALOX12LMNAMETAP2METAP1 | |
| Oxyquinoline SCHEMBL360625 | 0.82 | ALDH1A1 (0.74) | ALDH1A1ALOX12LMNAMETAP2METAP1 | |
| Oxyquinoline SCHEMBL28769239 | 0.81 | TSHR (0.68) | ALDH1A1ALOX12LMNAMETAP2METAP1 | |
| Quinolinic Acid SCHEMBL28077234 | 0.80 | ALDH1A1 (0.76) | ALDH1A1ALOX12LMNAMETAP2METAP1 | |
| Oxyquinoline SCHEMBL28459062 | 0.80 | MMP2 (0.84) | ALDH1A1ALOX12LMNAMETAP2METAP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106103605-A | Antifouling composition | 佐敦集团 | 2016-11-09 | — | — | CN | disclosed |