Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | RHEB | Q15382 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5198758 | 0.80 | HTT (0.49) | HPGDALDH1A1HTTCXCL8TSHR | |
| SCHEMBL6036733 | 0.80 | LTA4H (0.42) | ALDH1A1LMNASMN1; SMN2KMT2ARHEB | |
| SCHEMBL921282 | 0.77 | HPGD (0.42) | HPGDSLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL1345301 | 0.76 | HPGD (0.41) | HPGDSLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL1436765 | 0.75 | HPGD (0.59) | HPGDSLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL1965366 | 0.74 | — | — | |
| SCHEMBL4637513 | 0.73 | PTGS2 (0.43) | LMNASMN1; SMN2 | |
| SCHEMBL11832667 | 0.73 | AR (0.41) | HPGDSLC6A2SLC6A4SLC6A3ALDH1A1 | |
| Bromide SCHEMBL28304801 | 0.73 | HPGD (0.57) | HPGDSLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL164522 | 0.72 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0400344-B1 | Pyridine derivatives and their use as fungicides | BASF AG (DE) | 1993-12-15 | — | — | EP | disclosed |
| US-5266579-A | Controlling phytopathogens | BASF AKTIENGESELLSCHAFT (DE) | 1993-11-30 | — | — | US | disclosed |
| US-5112828-A | Horticulture, agriculture | BASF AKTIENGESELLSCHAFT (DE) | 1992-05-12 | — | — | US | disclosed |
| EP-0400344-A1 | Pyridine derivatives and their use as fungicides | BASF Aktiengesellschaft (DE) | 1990-12-05 | — | — | EP | disclosed |