Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 3/20 | 0.41 |
| ▸ | IDH1 | O75874 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | MAPT | P10636 | 7/20 | 0.41 |
| ▸ | POLB | P06746 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 5/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5043998 | 0.89 | ALDH1A1 (0.46) | KLKB1IDH1ALDH1A1MAPTPOLB | |
| SCHEMBL5039474 | 0.88 | NPC1 (0.43) | KLKB1IDH1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL5044987 | 0.88 | HTR2A (0.47) | IDH1ALDH1A1HPGDHTR2AHTR2C | |
| SCHEMBL5044990 | 0.86 | EIF4E (0.46) | ALDH1A1MAPTPOLBMEN1KMT2A | |
| SCHEMBL5039908 | 0.86 | ALDH1A1 (0.43) | KLKB1IDH1ALDH1A1MAPTPOLB | |
| SCHEMBL5046011 | 0.85 | HTR2A (0.48) | IDH1ALDH1A1HPGDHTR2AHTR2C | |
| SCHEMBL5049089 | 0.85 | HPGD (0.44) | KLKB1IDH1ALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL5049025 | 0.84 | SREBF2 (0.42) | KLKB1IDH1ALDH1A1MAPTPOLB | |
| SCHEMBL5048727 | 0.84 | ALDH1A1 (0.47) | KLKB1ALDH1A1MAPTPOLBMEN1 | |
| SCHEMBL5047822 | 0.82 | HTR2A (0.51) | IDH1HPGDHTR2AHTR2CSLC6A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1583762-B1 | PYRROLYL-THIAZOLES AND THEIR USE AS CB 1 RECEPTOR INVERSE AGONISTS | HOFFMANN LA ROCHE (CH) | 2008-07-09 | — | — | EP | disclosed |
| US-7135488-B2 | Pyrrolyl-thiazole derivatives | HOFFMANN-LA ROCHE INC. (US) | 2006-11-14 | — | — | US | disclosed |
| EP-1583762-A1 | PYRROLYL-THIAZOLES AND THEIR USE AS CB 1 RECEPTOR INVERSE AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-10-12 | — | — | EP | disclosed |
| WO-2004060888-A1 | NOVEL CB 1 RECEPTOR INVERSE AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2004-07-22 | — | — | WO | disclosed |