Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRG2 | P18507 | 7/20 | 0.53 |
| ▸ | GABRB3 | P28472 | 7/20 | 0.53 |
| ▸ | GABRA5 | P31644 | 7/20 | 0.53 |
| ▸ | GABRA3 | P34903 | 7/20 | 0.53 |
| ▸ | GABRA1 | P14867 | 6/20 | 0.53 |
| ▸ | IDO1 | P14902 | 2/20 | 0.47 |
| ▸ | METAP2 | P50579 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HK1 | P19367 | 1/20 | 0.46 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28104975 | 0.84 | ALDH1A1 (0.42) | GABRG2GABRB3GABRA5GABRA3GABRA1 | |
| SCHEMBL28458125 | 0.79 | GABRG2 (0.47) | GABRG2GABRB3GABRA5GABRA3GABRA1 | |
| SCHEMBL30719418 | 0.78 | HDAC4 (0.46) | GABRG2GABRB3GABRA5GABRA3GABRA1 | |
| SCHEMBL16780594 | 0.78 | HDAC4 (0.46) | GABRG2GABRB3GABRA5GABRA3GABRA1 | |
| SCHEMBL29473316 | 0.77 | RAB9A (0.58) | GABRG2GABRB3GABRA5GABRA3GABRA1 | |
| SCHEMBL17460455 | 0.77 | RAB9A (0.58) | GABRG2GABRB3GABRA5GABRA3GABRA1 | |
| SCHEMBL3464923 | 0.77 | MEN1 (0.52) | METAP2RAB9AALDH1A1MAPTHPGD | |
| SCHEMBL14802112 | 0.77 | BCHE (0.47) | IDO1METAP2RAB9AALDH1A1MAPT | |
| SCHEMBL913810 | 0.77 | NOTUM (0.47) | IDO1RAB9AMAPTNPC1SMN1; SMN2 | |
| SCHEMBL27862933 | 0.77 | GABRG2 (0.48) | GABRG2GABRB3GABRA5GABRA3IDO1 |
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-106397423-A | Organic compound taking pyridine as core and application thereof to OLED | 江苏三月光电科技有限公司 | 2017-02-15 | — | — | CN | disclosed |
| CN-106397415-A | Pyridine-based five-membered-ring substituted compound and application thereof | 江苏三月光电科技有限公司 | 2017-02-15 | — | — | CN | disclosed |
| CN-1556788-A | Muscarinic agonists | — | 2004-12-22 | — | — | CN | disclosed |