Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCF1 | P14598 | 2/20 | 0.73 |
| ▸ | MMP9 | P14780 | 2/20 | 0.50 |
| ▸ | MMP1 | P03956 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | NR4A2 | P43354 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | CASP7 | P55210 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Quinoline SCHEMBL28231960 | 0.89 | NCF1 (0.75) | NCF1MMP9MMP1CYP1A2NR4A2 | |
| SCHEMBL1120035 | 0.85 | NCF1 (1.00) | NCF1MMP9MMP1CYP1A2NR4A2 | |
| SCHEMBL29557788 | 0.85 | NCF1 (1.00) | NCF1MMP9MMP1CYP1A2NR4A2 | |
| Hydrochloric Acid SCHEMBL27703457 | 0.84 | NCF1 (0.96) | NCF1MMP9MMP1CYP1A2NR4A2 | |
| Iodide SCHEMBL27942629 | 0.84 | NCF1 (0.96) | NCF1MMP9MMP1CYP1A2NR4A2 | |
| Hydrochloric Acid SCHEMBL4754644 | 0.84 | NCF1 (0.96) | NCF1MMP9MMP1CYP1A2NR4A2 | |
| Hydrochloric Acid SCHEMBL29209114 | 0.84 | NCF1 (0.96) | NCF1MMP9MMP1CYP1A2NR4A2 | |
| Iodide SCHEMBL27879134 | 0.82 | NCF1 (0.92) | NCF1MMP9MMP1CYP1A2NR4A2 | |
| SCHEMBL115674 | 0.82 | NCF1 (0.72) | NCF1NR4A2ALDH1A1KDM4EKMT2A | |
| SCHEMBL29961464 | 0.82 | NCF1 (0.72) | NCF1NR4A2ALDH1A1KDM4EKMT2A |
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 |