Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 12/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | PPARD | Q03181 | 5/20 | 0.48 |
| ▸ | PPARG | P37231 | 4/20 | 0.48 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.46 |
| ▸ | FABP2 | P12104 | 1/20 | 0.45 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.45 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.43 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5266201 | 0.85 | PPARA (0.48) | PPARAMEN1KMT2AMAPTPPARD | |
| SCHEMBL1148134 | 0.81 | PPARA (0.56) | PPARACYP1A2CYP3A4MEN1KMT2A | |
| SCHEMBL21748609 | 0.81 | MAP4K4 (0.62) | PPARACYP1A2CYP3A4MEN1KMT2A | |
| SCHEMBL7253892 | 0.79 | PPARA (0.44) | PPARAPPARDPPARGL3MBTL1MAOB | |
| SCHEMBL10406787 | 0.79 | PTGS2 (0.48) | PPARACYP1A2CYP3A4MEN1KMT2A | |
| SCHEMBL21991957 | 0.77 | MAP4K4 (0.58) | PPARACYP1A2CYP3A4MEN1KMT2A | |
| SCHEMBL5923784 | 0.77 | PPARA (0.64) | PPARACYP1A2CYP3A4MEN1KMT2A | |
| SCHEMBL8834350 | 0.75 | PPARA (0.49) | PPARACYP1A2CYP3A4MEN1KMT2A | |
| SCHEMBL21991555 | 0.75 | PPARA (0.61) | PPARACYP1A2CYP3A4MEN1KMT2A | |
| SCHEMBL12859831 | 0.75 | PPARA (0.49) | PPARACYP1A2CYP3A4MEN1KMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7807138-B2 | Biomarkers of metabolic responses to hepatic drugs | METABOLON, INC. (US) | 2010-10-05 | — | — | US | disclosed |
| US-20080213745-A1 | Biomarkers Of Metabolic Responses To Hepatotoxicants And Carcinogens | METABOLON, INC. | 2008-09-04 | — | — | US | disclosed |
| US-20080176266-A1 | Biomarkers Of Metabolic Responses To Hepatotoxicants And Carcinogens | METABOLON, INC. | 2008-07-24 | — | — | US | disclosed |
| US-4082913-A | ANTI-ATHEROSCLEROSIS | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1978-04-04 | — | — | US | disclosed |
| US-3970694-A | ANTICHOLESTEROL | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1976-07-20 | — | — | US | disclosed |