Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.78 |
| ▸ | MAOA | P21397 | 1/20 | 0.78 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.71 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.70 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.67 |
| ▸ | MEN1 | O00255 | 3/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.62 |
| ▸ | NPC1 | O15118 | 2/20 | 0.62 |
| ▸ | RAB9A | P51151 | 2/20 | 0.62 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 2/20 | 0.61 |
| ▸ | CA4 | P22748 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 5/20 | 0.59 |
| ▸ | MITF | O75030 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | GFER | P55789 | 1/20 | 0.59 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.59 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| Anisole SCHEMBL28723995 | 1.00 | LTA4H (0.78) | LTA4HMAOASMN1; SMN2TDP1MAPK1 | |
| SCHEMBL177916 | 0.91 | TDP1 (0.84) | LTA4HMAOASMN1; SMN2TDP1MAPK1 | |
| Hydrochloric Acid SCHEMBL23748586 | 0.89 | ALDH1A1 (0.85) | LTA4HMAOASMN1; SMN2TDP1MAPK1 | |
| Aniline SCHEMBL27848079 | 0.89 | TDP1 (0.80) | LTA4HMAOASMN1; SMN2TDP1MAPK1 | |
| Benzene SCHEMBL27257767 | 0.89 | TDP1 (0.89) | LTA4HMAOASMN1; SMN2TDP1MAPK1 | |
| Diphenylether SCHEMBL28089995 | 0.89 | MAOA (1.00) | LTA4HMAOASMN1; SMN2TDP1ALDH1A1 | |
| SCHEMBL17283659 | 0.89 | LTA4H (1.00) | LTA4HMAOASMN1; SMN2MAPK1ALDH1A1 | |
| SCHEMBL554324 | 0.89 | MAOA (1.00) | LTA4HMAOASMN1; SMN2TDP1ALDH1A1 | |
| SCHEMBL491503 | 0.89 | LTA4H (1.00) | LTA4HMAOASMN1; SMN2MAPK1ALDH1A1 | |
| 4-Phenoxyaniline SCHEMBL159084 | 0.89 | MAOA (1.00) | LTA4HMAOASMN1; SMN2TDP1ALDH1A1 |
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 |