Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 2/20 | 0.59 |
| ▸ | CNR2 | P34972 | 2/20 | 0.59 |
| ▸ | ACHE | P22303 | 1/20 | 0.59 |
| ▸ | PTGER4 | P35408 | 8/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.53 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.49 |
| ▸ | FAAH | O00519 | 1/20 | 0.49 |
| ▸ | MGLL | Q99685 | 1/20 | 0.49 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.49 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.49 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.49 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL29805498 | 0.87 | PTGER4 (0.66) | CNR1CNR2ACHEPTGER4CYP1A2 | |
| SCHEMBL1225871 | 0.87 | PTGER4 (0.66) | CNR1CNR2ACHEPTGER4CYP1A2 | |
| SCHEMBL2432735 | 0.85 | PTGER4 (0.72) | CNR1CNR2PTGER4CYP1A2CYP3A4 | |
| SCHEMBL14584207 | 0.84 | PTGER4 (0.60) | CNR1CNR2ACHEPTGER4CYP1A2 | |
| SCHEMBL24273140 | 0.82 | PTGER4 (0.74) | PTGER4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL3783075 | 0.82 | PTGER4 (0.54) | CNR1PTGER4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL29459618 | 0.82 | PTGER4 (0.54) | CNR1PTGER4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3500587 | 0.82 | CYP1A2 (0.70) | CNR1PTGER4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL30493974 | 0.82 | CYP1A2 (0.70) | CNR1PTGER4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL1218213 | 0.81 | PTGER4 (0.71) | CNR1PTGER4CYP1A2CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004058720-A2 | COMPOUND LIBRARIES OF 1,3,5-SUBSTITUTE INDAZOLE DERIVATIVES AS COMPOUNDS FOR TARGETTING COMPOUNDS CAPABLE OF BINDING TO THE G-PROTEIN COUPLED RECEPTOR | BIOFOCUS PLC (GB) | 2004-07-15 | — | — | WO | disclosed |