Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 4/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11315378 | 0.90 | SLC18A3 (0.44) | SLC18A3SIGMAR1GAADRD2CYP2D6 | |
| SCHEMBL11314124 | 0.90 | SLC18A3 (0.41) | SLC18A3SIGMAR1GAAMAPTGRIN2B | |
| SCHEMBL11316072 | 0.82 | SLC18A3 (0.47) | SLC18A3SIGMAR1GAADRD2CYP2D6 | |
| SCHEMBL11315431 | 0.78 | SRD5A1 (0.46) | SLC18A3MAPTDRD2SRD5A1CYP1A2 | |
| SCHEMBL60704 | 0.78 | SLC18A3 (0.56) | SLC18A3SIGMAR1GAAMAPTGRIN2B | |
| SCHEMBL190417 | 0.77 | SLC18A3 (0.67) | SLC18A3SIGMAR1GAAMAPTGRIN2B | |
| SCHEMBL41763 | 0.77 | — | — | |
| Benzene SCHEMBL23070411 | 0.75 | SLC18A3 (0.64) | SLC18A3SIGMAR1GAAMAPTGRIN2B | |
| Hydrogen Peroxide SCHEMBL2353767 | 0.75 | SLC18A3 (0.64) | SLC18A3SIGMAR1GRIN2BCYP2D6CYP2C19 | |
| Ammonia Solution, Strong SCHEMBL3932661 | 0.75 | SLC18A3 (0.64) | SLC18A3SIGMAR1GAAMAPTGRIN2B |
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 |
|---|---|---|---|---|---|---|---|
| US-4293717-A | Process for preparing aldehydes and diols | BAYER AKTIENGESELLSCHAFT (DE) | 1981-10-06 | — | — | US | claimed |
| US-4293717-A | Process for preparing aldehydes and diols | BAYER AKTIENGESELLSCHAFT (DE) | 1981-10-06 | — | — | US | disclosed |