Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.38 |
| ▸ | GLP1R | P43220 | 1/20 | 0.37 |
| ▸ | GCGR | P47871 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | USP5 | P45974 | 1/20 | 0.36 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.36 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8294048 | 0.86 | CYP3A4 (0.40) | FFAR1NAPRTAKR1C3AKR1C2ADRB1 | |
| SCHEMBL1983382 | 0.84 | CYP3A4 (0.44) | NAPRTADRB1ADRB3CYP3A4CYP2D6 | |
| SCHEMBL7101478 | 0.83 | NAPRT (0.46) | FFAR1NAPRTAKR1C3AKR1C2ADRB1 | |
| SCHEMBL11900194 | 0.78 | CYP3A4 (0.41) | NAPRTAKR1C3AKR1C2CYP3A4CYP2D6 | |
| SCHEMBL12373162 | 0.78 | AOC3 (0.42) | NAPRTCYP3A4CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL7115734 | 0.78 | GABBR2 (0.47) | CYP3A4CYP2D6LMNAALDH1A1USP5 | |
| SCHEMBL6426357 | 0.75 | CYP3A4 (0.43) | NAPRTADRB1ADRB3CYP3A4CYP2D6 | |
| SCHEMBL6334139 | 0.75 | CYP3A4 (0.43) | NAPRTADRB1ADRB3CYP3A4CYP2D6 | |
| SCHEMBL6541805 | 0.75 | CYP3A4 (0.43) | NAPRTADRB1ADRB3CYP3A4CYP2D6 | |
| SCHEMBL2269524 | 0.75 | CYP3A4 (0.39) | CYP3A4CYP2D6SLC6A2SLC6A4SLC6A3 |
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-5994540-A | HYDROXY- AND CHLORO-PYRIDYLPYRIDAZINONE DERIVATIVES | LONZA, LTD. (CH) | 1999-11-30 | — | — | US | disclosed |
| US-5760236-A | CHEMICAL INTERMEDIATES FOR PHARMACEUTICALS | LONZA, LTD. (CH) | 1998-06-02 | — | — | US | disclosed |