Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.73 |
| ▸ | NPC1 | O15118 | 6/20 | 0.73 |
| ▸ | ALPL | P05186 | 1/20 | 0.73 |
| ▸ | ALPI | P09923 | 1/20 | 0.73 |
| ▸ | ALPG | P10696 | 1/20 | 0.73 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | GSK3B | P49841 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | GSK3A | P49840 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 4/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL3455705 | 1.00 | RAB9A (0.73) | RAB9ANPC1ALPLALPIALPG | |
| SCHEMBL13162015 | 0.85 | NPC1 (0.55) | RAB9ANPC1ALPLALPIALPG | |
| SCHEMBL2075958 | 0.79 | NPC1 (0.55) | RAB9ANPC1ALPLALPIALPG | |
| SCHEMBL32690627 | 0.79 | AXL (0.56) | RAB9ANPC1ALPLALPIALPG | |
| SCHEMBL27753306 | 0.76 | NPC1 (0.52) | RAB9ANPC1ALPLALPIALPG | |
| SCHEMBL9412184 | 0.75 | RAB9A (0.52) | RAB9ANPC1ALPLALPIALPG | |
| SCHEMBL12160921 | 0.73 | NPC1 (0.46) | RAB9ANPC1ALPLALPIALPG | |
| SCHEMBL7983727 | 0.72 | GAA (0.67) | RAB9ANPC1KDM4EALDH1A1KMT2A | |
| SCHEMBL13753386 | 0.71 | SMN1; SMN2 (0.55) | RAB9ANPC1ALDH1A1GSK3BGAA | |
| SCHEMBL8198182 | 0.71 | NPC1 (1.00) | RAB9ANPC1KDM4EALDH1A1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5416103-A | N-cyclohex(en)yl-pyridine carboxamides and compositions containing them for controlling fungal pests | BASF AKTIENGESELLSCHAFT (DE) | 1995-05-16 | — | — | US | disclosed |