Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 3/20 | 0.53 |
| ▸ | NOS2 | P35228 | 3/20 | 0.53 |
| ▸ | NOS1 | P29475 | 2/20 | 0.53 |
| ▸ | PI4KA | P42356 | 1/20 | 0.53 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.53 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.53 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.53 |
| ▸ | MAOA | P21397 | 3/20 | 0.39 |
| ▸ | MAOB | P27338 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.35 |
| ▸ | NCF1 | P14598 | 1/20 | 0.35 |
| ▸ | APAF1 | O14727 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| 2-Aminopyridine SCHEMBL9487893 | 0.85 | NOS3 (0.52) | NOS3NOS2NOS1PI4KAPI4K2B | |
| 2-Aminopyridine SCHEMBL28747830 | 0.78 | NOS3 (0.80) | NOS3NOS2NOS1PI4KAPI4K2B | |
| 2-Aminopyridine SCHEMBL5268880 | 0.77 | NOS3 (0.59) | NOS3NOS2NOS1PI4KAPI4K2B | |
| 2-Aminopyridine SCHEMBL10589578 | 0.77 | ALDH1A1 (0.59) | NOS3NOS2NOS1PI4KAPI4K2B | |
| SCHEMBL3912567 | 0.75 | TSHR (0.46) | NOS3NOS2NOS1KMT2AMEN1 | |
| 2-Aminopyridine SCHEMBL9115892 | 0.74 | NOS3 (0.73) | NOS3NOS2NOS1PI4KAPI4K2B | |
| SCHEMBL14851141 | 0.74 | NOS3 (0.54) | NOS3NOS2NOS1KMT2AMEN1 | |
| 2-Aminopyridine SCHEMBL28885375 | 0.73 | — | — | |
| 2-Aminopyridine SCHEMBL7007186 | 0.73 | — | — | |
| 2-Aminopyridine SCHEMBL17844 | 0.73 | — | — |
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-0366206-B1 | REMOVING HYDROGEN SULPHIDE FROM A GAS MIXTURE | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1993-01-13 | — | — | EP | claimed |