Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.74 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
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 SCHEMBL7044581 | 1.00 | ALDH1A1 (0.74) | ALDH1A1CYP1A2TSHRLMNAALOX12 | |
| Quinoline SCHEMBL27267356 | 0.98 | ALDH1A1 (0.71) | ALDH1A1CYP1A2TSHRLMNAALOX12 | |
| Quinoline SCHEMBL27743776 | 0.98 | ALDH1A1 (0.71) | ALDH1A1CYP1A2TSHRLMNAALOX12 | |
| Quinoline SCHEMBL28062159 | 0.94 | ALDH1A1 (0.65) | ALDH1A1CYP1A2TSHRLMNAALOX12 | |
| Quinoline SCHEMBL25435077 | 0.93 | ALDH1A1 (0.77) | ALDH1A1CYP1A2TSHRLMNANPC1 | |
| Quinoline SCHEMBL10951645 | 0.92 | ALDH1A1 (0.63) | ALDH1A1CYP1A2TSHRLMNAALOX12 | |
| Quinoline SCHEMBL9270593 | 0.89 | ALDH1A1 (0.59) | ALDH1A1CYP1A2TSHRLMNAALOX12 | |
| Quinoline SCHEMBL9355965 | 0.89 | ALDH1A1 (0.94) | ALDH1A1CYP1A2TSHRLMNANPC1 | |
| SCHEMBL3189055 | 0.89 | ALDH1A1 (0.94) | ALDH1A1CYP1A2TSHRLMNANPC1 | |
| Quinoline SCHEMBL28302932 | 0.89 | ALDH1A1 (0.94) | ALDH1A1CYP1A2TSHRLMNANPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4522701-A | HEAT SOAKING PETROLEUM PITCH AND STRIPPING DISTILLABLE OILS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1985-06-11 | — | — | US | disclosed |