Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | TSHR | P16473 | 3/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | GSR | P00390 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9689843 | 0.82 | ALDH1A1 (0.46) | ALDH1A1TSHRLMNAGAAPOLB | |
| SCHEMBL29653561 | 0.81 | POLB (0.45) | ALDH1A1TSHRLMNAGAAPOLB | |
| SCHEMBL342291 | 0.81 | POLB (0.45) | ALDH1A1TSHRLMNAGAAPOLB | |
| SCHEMBL9911750 | 0.79 | ALDH1A1 (0.68) | ALDH1A1TSHRLMNAGAASMN1; SMN2 | |
| SCHEMBL8940768 | 0.79 | ALDH1A1 (0.79) | ALDH1A1TSHRLMNAGAAPOLB | |
| SCHEMBL9280145 | 0.73 | ALDH1A1 (0.75) | ALDH1A1TSHRLMNAGAAPOLB | |
| SCHEMBL38719 | 0.73 | ALDH1A1 (1.00) | ALDH1A1TSHRLMNAGAAPOLB | |
| SCHEMBL21544165 | 0.73 | ALDH1A1 (0.59) | ALDH1A1TSHRLMNAGAASMN1; SMN2 | |
| SCHEMBL16022232 | 0.72 | ALDH1A1 (0.52) | ALDH1A1TSHRLMNAGAAPOLB | |
| Lithium Ion SCHEMBL25306574 | 0.72 | ALDH1A1 (0.63) | ALDH1A1TSHRLMNAGAASMN1; SMN2 |
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-5117061-A | Process of preparing substituted anilines | ETHYL CORPORATION (US) | 1992-05-26 | — | — | US | disclosed |