Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8539961 | 0.90 | CYP2C19 (0.40) | HPGDCYP2C19FFAR1ALDH1A1MTNR1A | |
| SCHEMBL8733336 | 0.83 | FFAR1 (0.47) | HPGDCYP2C19FFAR1ALDH1A1MTNR1A | |
| SCHEMBL14071758 | 0.79 | FFAR1 (0.52) | CYP2C19FFAR1LMNA | |
| SCHEMBL3270768 | 0.79 | FFAR1 (0.52) | CYP2C19FFAR1LMNA | |
| SCHEMBL27163620 | 0.79 | FFAR1 (0.47) | HPGDCYP2C19FFAR1ALDH1A1POLB | |
| SCHEMBL11088941 | 0.75 | ALDH1A1 (0.53) | HPGDCYP2C19ALDH1A1LMNAKMT2A | |
| SCHEMBL27423377 | 0.73 | TSHR (0.48) | CYP2C19FFAR1ALDH1A1LMNAKMT2A | |
| SCHEMBL9797007 | 0.73 | TSHR (0.48) | CYP2C19FFAR1ALDH1A1LMNAKMT2A | |
| SCHEMBL27685597 | 0.72 | KMT2A (0.51) | HPGDALDH1A1LMNAPOLBKMT2A | |
| SCHEMBL7223142 | 0.72 | HDAC4 (0.43) | POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1019720-A1 | COMBINATORIAL PROCESS FOR PREPARING TETRAHYDROQUINOLINE LIBRARIES | ELI LILLY AND COMPANY (US) | 2000-07-19 | — | — | EP | disclosed |
| WO-1998027427-A1 | COMBINATORIAL PROCESS FOR PREPARING TETRAHYDROQUINOLINE LIBRARIES | ELI LILLY AND COMPANY (US) | 1998-06-25 | — | — | WO | disclosed |