Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.61 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | FDPS | P14324 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2024077 | 1.00 | SLC6A2 (0.61) | SLC6A2TAAR1HIF1ASMN1; SMN2CYP2D6 | |
| SCHEMBL2024074 | 1.00 | SLC6A2 (0.61) | SLC6A2TAAR1HIF1ASMN1; SMN2CYP2D6 | |
| SCHEMBL516033 | 0.86 | TAAR1 (0.73) | SLC6A2TAAR1HIF1ASMN1; SMN2CYP2D6 | |
| Ammonia Solution, Strong SCHEMBL2477835 | 0.84 | SLC6A2 (0.70) | SLC6A2TAAR1HIF1ASMN1; SMN2CYP2D6 | |
| SCHEMBL15637553 | 0.83 | SLC6A2 (0.57) | SLC6A2TAAR1HIF1ASMN1; SMN2CYP2D6 | |
| SCHEMBL11782901 | 0.80 | SLC6A2 (0.64) | SLC6A2TAAR1HIF1ASMN1; SMN2CYP2D6 | |
| SCHEMBL4676258 | 0.80 | TAAR1 (0.64) | SLC6A2TAAR1HIF1ASMN1; SMN2CYP2D6 | |
| Aniline SCHEMBL5261863 | 0.80 | TSHR (0.50) | SLC6A2TAAR1HIF1ASMN1; SMN2CYP2D6 | |
| SCHEMBL9183600 | 0.79 | TAAR1 (0.47) | SLC6A2TAAR1SMN1; SMN2KDM4EPOLB | |
| SCHEMBL5428396 | 0.79 | TAAR1 (0.47) | SLC6A2TAAR1SMN1; SMN2KDM4EPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001009127-A1 | BENZOXAZINE DERIVATIVES AND THEIR THERAPEUTIC USE | AVENTIS PHARMA S.A. (FR) | 2001-02-08 | — | — | WO | disclosed |