Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | GABRA1 | P14867 | 6/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 6/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 6/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11423319 | 0.88 | ALDH1A1 (0.50) | TSHRCASP1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL11415778 | 0.81 | ALDH1A1 (0.47) | SMN1; SMN2MAPTALDH1A1POLBHPGD | |
| SCHEMBL21916240 | 0.79 | KDM4E (0.49) | TSHRCASP1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL3770989 | 0.78 | ALDH1A1 (0.57) | TSHRCASP1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL11416058 | 0.78 | CYP1A2 (0.43) | TSHRKDM4EMAPTALDH1A1MAPK1 | |
| SCHEMBL11430781 | 0.73 | HPGD (0.38) | CASP1KDM4EMAPTALDH1A1L3MBTL1 | |
| SCHEMBL11416483 | 0.72 | GABRA1 (0.42) | TSHRCASP1SMN1; SMN2KDM4EMAPT | |
| Acetonitrile SCHEMBL28488651 | 0.70 | TSHR (0.78) | TSHRCASP1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL10228777 | 0.70 | ALDH1A1 (0.54) | TSHRCASP1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL5666673 | 0.70 | TSHR (0.59) | TSHRCASP1SMN1; SMN2KDM4EMAPT |
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-4198428-A | PESTICIDES, MICROBIOCIDES, MOLLUSCOCIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1980-04-15 | — | — | US | disclosed |