Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 15/20 | 0.63 |
| ▸ | TAS1R2 | Q8TE23 | 14/20 | 0.63 |
| ▸ | TAS1R1 | Q7RTX1 | 14/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9153874 | 0.84 | TAS1R3 (0.44) | TAS1R3TAS1R2TAS1R1ALDH1A1KDM4E | |
| SCHEMBL9157091 | 0.84 | HSD11B1 (0.48) | TAS1R3TAS1R2TAS1R1ALDH1A1KDM4E | |
| SCHEMBL4735546 | 0.81 | TAS1R3 (0.44) | TAS1R3TAS1R2TAS1R1ALDH1A1KDM4E | |
| SCHEMBL27755168 | 0.81 | TAS1R3 (0.78) | TAS1R3TAS1R2TAS1R1ALDH1A1 | |
| SCHEMBL3165964 | 0.81 | ALDH1A1 (0.68) | ALDH1A1KDM4ESMN1; SMN2MEN1CYP1A2 | |
| SCHEMBL31583752 | 0.79 | P2RX7 (0.58) | ALDH1A1KDM4ESMN1; SMN2MEN1CYP1A2 | |
| SCHEMBL700898 | 0.77 | TAS1R3 (1.00) | TAS1R3TAS1R2TAS1R1ALDH1A1KMT2A | |
| SCHEMBL700763 | 0.77 | TAS1R3 (1.00) | TAS1R3TAS1R2TAS1R1 | |
| SCHEMBL7689964 | 0.77 | MAPT (0.54) | TAS1R3TAS1R2TAS1R1ALDH1A1 | |
| SCHEMBL13638984 | 0.76 | TAS1R3 (0.79) | TAS1R3TAS1R2TAS1R1ALDH1A1KMT2A |
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 2 patents. 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 |
| EP-0589313-A1 | Cyclohex(en)ylcarboxamides, process for their preparation and anti-fungal agents containing them | BASF Aktiengesellschaft (DE) | 1994-03-30 | — | — | EP | disclosed |