Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | BRD4 | O60885 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | EDNRB | P24530 | 1/20 | 0.34 |
| ▸ | EDNRA | P25101 | 1/20 | 0.34 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | BRD2 | P25440 | 1/20 | 0.33 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL1670583 | 0.88 | MAOA (0.38) | MAOAMAOBPTGS2MAPTBRD4 | |
| SCHEMBL12986874 | 0.84 | CREBBP (0.39) | PTGS2MAPTBRD4RAB9ANPSR1 | |
| SCHEMBL12800447 | 0.82 | PTGS2 (0.41) | PTGS2MAPTBRD4NPC1RAB9A | |
| SCHEMBL1670344 | 0.78 | PTGS2 (0.39) | MAOAMAOBPTGS2MAPTBRD4 | |
| SCHEMBL1670731 | 0.74 | BRD4 (0.34) | BRD4 | |
| SCHEMBL1670708 | 0.72 | PTGS2 (0.43) | PTGS2MAPTBRD4NPC1RAB9A | |
| SCHEMBL12800962 | 0.72 | PTGS2 (0.40) | PTGS2MAPTBRD4NPC1RAB9A | |
| SCHEMBL1670920 | 0.70 | PTGS2 (0.47) | PTGS2BRD4NPSR1CREBBPBRD2 | |
| SCHEMBL12986067 | 0.70 | ALDH1A1 (0.35) | MAPTBRD4SMN1; SMN2CREBBPALDH1A1 | |
| SCHEMBL12800442 | 0.69 | BRD4 (0.33) | MAPTBRD4NPC1SMN1; SMN2NPSR1 |
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-2011042477-A1 | SUBSTITUTED PYRROLES AND IMIDAZOLES AS ESTROGEN RECEPTOR LIGANDS | KARO BIO AB (SE) | 2011-04-14 | — | — | WO | disclosed |