Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.38 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.38 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10921276 | 0.90 | CA1 (0.40) | ALDH1A1NPC1RAB9ACA1CA2 | |
| SCHEMBL10924511 | 0.75 | S1PR3 (0.41) | ALDH1A1NPC1RAB9ASMN1; SMN2S1PR3 | |
| SCHEMBL14153602 | 0.67 | ALDH1A1 (0.55) | ALDH1A1RAB9ASMN1; SMN2CA1SLC1A2 | |
| SCHEMBL8814823 | 0.63 | SLC1A2 (0.51) | ALDH1A1RAB9ASMN1; SMN2CA1SLC1A2 | |
| SCHEMBL37273 | 0.62 | ALDH1A1 (0.68) | ALDH1A1NPC1RAB9ASMN1; SMN2CA1 | |
| SCHEMBL27997270 | 0.62 | LMNA (0.59) | ALDH1A1NPC1SMN1; SMN2CA1CA2 | |
| SCHEMBL28033840 | 0.61 | LMNA (0.63) | ALDH1A1RAB9ASMN1; SMN2CA1SLC1A2 | |
| SCHEMBL12262967 | 0.61 | SLC1A2 (0.63) | ALDH1A1RAB9ASMN1; SMN2CA1SLC1A2 | |
| SCHEMBL27529872 | 0.61 | SLC1A2 (0.63) | ALDH1A1RAB9ASMN1; SMN2CA1SLC1A2 | |
| SCHEMBL28641833 | 0.61 | HDAC3 (0.58) | ALDH1A1RAB9ASMN1; SMN2CA1SLC1A2 |
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-0061836-B1 | AMIDE DERIVATIVES, PROCESSES FOR PREPARING THEM, THEIR USE AS FUNGICIDES AND PESTICIDAL COMPOSITIONS CONTAINING THEM | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1986-12-30 | — | — | EP | disclosed |
| US-4506084-A | N-HETEROCYCLYLEMTHYL AMIDES, HERBICIDES, FUNGICIDES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1985-03-19 | — | — | US | disclosed |
| US-4432784-A | HERBICIDES, FUNGICIDES WHICH ARE N-HETEROCYCLYLMETHYL AMIDES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1984-02-21 | — | — | US | disclosed |
| EP-0061836-A2 | Amide derivatives, processes for preparing them, their use as fungicides and pesticidal compositions containing them | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1982-10-06 | — | — | EP | disclosed |