Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.38 |
| ▸ | TBXAS1 | P24557 | 6/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9790521 | 0.89 | HCAR2 (0.42) | HCAR2HDAC3HDAC1HDAC2TBXAS1 | |
| SCHEMBL9790519 | 0.82 | HCAR2 (0.45) | HCAR2HDAC3HDAC1HDAC2TBXAS1 | |
| SCHEMBL26290927 | 0.75 | LMNA (0.57) | HDAC3HDAC1HDAC2TBXAS1L3MBTL1 | |
| SCHEMBL26064181 | 0.75 | CES1 (0.49) | LMNA | |
| SCHEMBL19918836 | 0.74 | L3MBTL1 (0.40) | L3MBTL1LMNA | |
| SCHEMBL1173742 | 0.73 | HCAR2 (0.52) | HCAR2LMNACYP1A2CYP3A4CYP11B1 | |
| SCHEMBL9282205 | 0.71 | HCAR2 (0.50) | HCAR2LMNACYP1A2CYP2C19CYP3A4 | |
| SCHEMBL20942642 | 0.70 | CA2 (0.41) | HCAR2HDAC3HDAC1HDAC2L3MBTL1 | |
| SCHEMBL18994356 | 0.70 | P2RX7 (0.37) | TBXAS1CYP1A2KDM4E | |
| SCHEMBL18387767 | 0.70 | LMNA (0.58) | HCAR2HDAC3HDAC1HDAC2TBXAS1 |
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-5073187-A | Plant growth regulators | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-12-17 | — | — | US | disclosed |
| EP-0347044-A2 | Pyrimidine derivatives | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1989-12-20 | — | — | EP | disclosed |