Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL10586952 | 0.81 | CYP19A1 (0.46) | CYP19A1CYP3A4 | |
| SCHEMBL10834213 | 0.78 | HTR1B (0.38) | CYP19A1SMN1; SMN2LMNAMAPTPOLB | |
| SCHEMBL10834848 | 0.74 | CYP19A1 (0.47) | CYP19A1SMN1; SMN2LMNAMAPTTSHR | |
| SCHEMBL9372769 | 0.71 | LMNA (0.48) | CYP19A1SMN1; SMN2LMNAKDM4ECYP1A2 | |
| SCHEMBL15452805 | 0.70 | CYP17A1 (0.34) | CYP19A1CYP2C9CYP3A4CYP2C19 | |
| SCHEMBL12870557 | 0.70 | CYP19A1 (0.40) | CYP19A1SMN1; SMN2MAPTTDP1KDM4E | |
| SCHEMBL12792525 | 0.70 | S1PR4 (0.40) | CYP19A1SMN1; SMN2MAPTTDP1TSHR | |
| SCHEMBL2625771 | 0.69 | SSTR4 (0.49) | SMN1; SMN2LMNAHTTMAPTKDM4E | |
| SCHEMBL9301221 | 0.69 | LMNA (0.46) | CYP19A1SMN1; SMN2LMNAKDM4ECYP1A2 | |
| SCHEMBL9886352 | 0.68 | SCN10A (0.38) | — |
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-4584373-A | MICROBIOCIDES, FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1986-04-22 | — | — | US | claimed |