Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 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 | |
|---|---|---|---|---|
| SCHEMBL11541537 | 0.85 | AHR (0.50) | AHRTP53ESR1CYP24A1ADRB2 | |
| SCHEMBL11538268 | 0.81 | AHR (0.43) | AHRMAPTPOLB | |
| SCHEMBL11540137 | 0.75 | AHR (0.51) | AHRTP53MAPTPOLB | |
| SCHEMBL5651399 | 0.75 | ALDH1A1 (0.53) | TP53CYP24A1KDM4EFAAHMGLL | |
| SCHEMBL11540763 | 0.75 | AHR (0.56) | AHRMAPTPOLBKDM4E | |
| SCHEMBL11537773 | 0.73 | CYP1A2 (0.42) | POLB | |
| SCHEMBL22571992 | 0.71 | AHR (0.57) | AHRTP53 | |
| SCHEMBL14123361 | 0.71 | AHR (0.48) | AHRFAAH | |
| SCHEMBL11648231 | 0.71 | AHR (0.39) | AHRESR1ADRB2ADRB1ADRB3 | |
| SCHEMBL17078095 | 0.71 | TSHR (0.48) | TP53MAPTESR1OPRM1KCNH2 |
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-4154945-A | Fungicidal substituted imidazoles | THE BOOTS COMPANY LIMITED (GB) | 1979-05-15 | — | — | US | disclosed |
| US-4080462-A | Fungicidal compositions containing substituted imidazoles | THE BOOTS COMPANY LIMITED (EN) | 1978-03-21 | — | — | US | disclosed |