Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.62 |
| ▸ | GAA | P10253 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 4/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | PAX8 | Q06710 | 3/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL18186299 | 0.86 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2GAAKMT2AHPGD | |
| SCHEMBL11277081 | 0.84 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2GAAKMT2AHPGD | |
| SCHEMBL6675790 | 0.83 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2GAAKMT2AHPGD | |
| SCHEMBL11280260 | 0.83 | ALDH1A1 (0.63) | ALDH1A1SMN1; SMN2GAAKMT2AHPGD | |
| SCHEMBL6680614 | 0.82 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2GAAKMT2AHPGD | |
| SCHEMBL16824919 | 0.81 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2GAAKMT2AHPGD | |
| SCHEMBL16824876 | 0.81 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2GAAKMT2AHPGD | |
| SCHEMBL16824922 | 0.80 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2GAAKMT2AHPGD | |
| SCHEMBL13236920 | 0.79 | GAA (0.63) | ALDH1A1SMN1; SMN2GAAKMT2AHPGD | |
| SCHEMBL27495191 | 0.79 | TDP1 (0.48) | ALDH1A1SMN1; SMN2LMNACYP1A2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-1075808-C | Aniline derivatives having nitric oxide synthase inhibitory activity | CHUGAI PHARMACEUTICAL CO LTD (JP) | 2001-12-05 | — | — | CN | disclosed |