Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | PTPN11 | Q06124 | 5/20 | 0.37 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7977502 | 0.89 | CYP1A2 (0.53) | CYP1A2CYP2C9SLC6A3LMNATSHR | |
| SCHEMBL7981878 | 0.83 | LMNA (0.57) | CYP1A2CYP2C9SLC6A3LMNAGAA | |
| SCHEMBL8801261 | 0.82 | CYP1A2 (0.44) | CYP1A2CYP2C9LMNAHTTSMN1; SMN2 | |
| SCHEMBL7977566 | 0.81 | HTT (0.42) | CYP1A2CYP2C9SLC6A3LMNAGAA | |
| SCHEMBL7980956 | 0.80 | CYP1A2 (0.56) | CYP1A2CYP2C9SLC6A3LMNASMN1; SMN2 | |
| SCHEMBL13410042 | 0.78 | GAA (0.47) | SLC6A3LMNAGAAHTTSMN1; SMN2 | |
| SCHEMBL30587182 | 0.77 | SMN1; SMN2 (0.49) | SLC6A3LMNAGAAHTTSMN1; SMN2 | |
| SCHEMBL6951228 | 0.77 | SMN1; SMN2 (0.49) | SLC6A3LMNAGAAHTTSMN1; SMN2 | |
| SCHEMBL6949718 | 0.75 | GAA (0.56) | CYP1A2CYP2C9SLC6A3LMNAGAA | |
| SCHEMBL31231118 | 0.75 | GAA (0.56) | CYP1A2CYP2C9SLC6A3LMNAGAA |
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-6194428-B1 | BRAIN DISORDERS; PSYCHOLOGICAL DISORDERS | BAYER AKTIENGESELLSCHAFT (DE) | 2001-02-27 | — | — | US | claimed |