Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | SYK | P43405 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL1137839 | 0.87 | RAB9A (0.41) | SMN1; SMN2HPGDMAPK1CYP3A4CYP1A2 | |
| SCHEMBL9834286 | 0.87 | TUBB4A (0.36) | SMN1; SMN2HPGDMEN1KMT2ACYP3A4 | |
| SCHEMBL27863553 | 0.84 | SMN1; SMN2 (0.43) | SMN1; SMN2HPGDSYKMEN1KMT2A | |
| SCHEMBL9833682 | 0.77 | HPGD (0.46) | SMN1; SMN2HPGDSYKMEN1KMT2A | |
| SCHEMBL4376433 | 0.75 | HPGD (0.44) | SMN1; SMN2HPGDSYKMEN1KMT2A | |
| SCHEMBL29682049 | 0.75 | ALDH1A1 (0.34) | TSHRADRA1ARAB9APDE4DKDM4E | |
| SCHEMBL7104913 | 0.75 | ALDH1A1 (0.34) | TSHRADRA1ARAB9APDE4DKDM4E | |
| SCHEMBL11918960 | 0.74 | RAB9A (0.42) | SMN1; SMN2HPGDMEN1KMT2AMAPK1 | |
| SCHEMBL27277639 | 0.74 | RAB9A (0.40) | SMN1; SMN2HPGDMEN1KMT2AMAPK1 | |
| SCHEMBL22978638 | 0.73 | SMN1; SMN2 (0.44) | SMN1; SMN2HPGDMEN1KMT2AMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0208452-B1 | PYRIDINE DERIVATIVES, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1991-09-18 | — | — | EP | disclosed |
| US-4738975-A | Pyridine derivatives, and use as anti-ulcer agents | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1988-04-19 | — | — | US | disclosed |
| EP-0208452-A2 | Pyridine derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1987-01-14 | — | — | EP | disclosed |