Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 5/20 | 0.44 |
| ▸ | APOB | P04114 | 6/20 | 0.43 |
| ▸ | MTTP | P55157 | 6/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 4/20 | 0.42 |
| ▸ | BRAF | P15056 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KIT | P10721 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | JAK1 | P23458 | 1/20 | 0.41 |
| ▸ | TYK2 | P29597 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GMNN | O75496 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5860337 | 0.86 | APOB (0.44) | SMOAPOBMTTPTRPV1BRAF | |
| SCHEMBL6661408 | 0.80 | GPR27 (0.44) | SMOAPOBMTTPPTGS1LMNA | |
| SCHEMBL5859183 | 0.80 | MAPT (0.49) | TRPV1LMNAMAPTNPC1GMNN | |
| SCHEMBL5860301 | 0.79 | SMO (0.44) | SMOAPOBMTTPMAPTJAK2 | |
| SCHEMBL5859923 | 0.78 | MAPT (0.49) | TRPV1BRAFLMNAMAPTKIT | |
| SCHEMBL5859049 | 0.77 | ROCK1 (0.47) | MAPTMAPK1TP53CYP3A4CYP2C9 | |
| SCHEMBL5859281 | 0.76 | CYP3A4 (0.48) | BRAFLMNAMAPTJAK2TYK2 | |
| SCHEMBL5860289 | 0.73 | PPARA (0.43) | APOBMTTPLMNAMAPTMAPK1 | |
| SCHEMBL5860280 | 0.73 | CYP46A1 (0.42) | LMNACYP2C9HTTSMN1; SMN2NPSR1 | |
| SCHEMBL5859178 | 0.70 | MAPT (0.48) | TRPV1LMNAMAPTSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7122543-B2 | Substituted benzoic acid derivatives having NF-κB inhibiting action | DAIICHI SUNTORY PHARMA CO., LTD. (JP) | 2006-10-17 | — | — | US | disclosed |
| EP-1437339-A1 | SUBSTITUTED BENZOIC ACID DERIVATIVES EXHIBITING NF-KAPPA B INHIBITING ACTIVITY | Daiichi Suntory Pharma Co., Ltd. (JP) | 2004-07-14 | — | — | EP | disclosed |