Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.36 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.36 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.36 |
| ▸ | XBP1 | P17861 | 2/20 | 0.35 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.35 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.35 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9360265 | 0.79 | CYP2A6 (0.48) | CYP2A6MAPTKDM4ELMNASMN1; SMN2 | |
| SCHEMBL9458506 | 0.78 | MLYCD (0.47) | MAPTS1PR1S1PR3HPGDKMT2A | |
| SCHEMBL9458496 | 0.75 | S1PR1 (0.33) | S1PR1S1PR3TAS2R14SLC6A2SLC6A4 | |
| SCHEMBL9361125 | 0.74 | CYP2A6 (0.56) | CYP2A6MAPTKDM4ELMNASMN1; SMN2 | |
| SCHEMBL15207303 | 0.74 | MAOB (0.42) | HAO1 | |
| SCHEMBL761802 | 0.73 | LMNA (0.57) | CYP2A6MAPTKDM4ELMNASMN1; SMN2 | |
| SCHEMBL30832956 | 0.73 | LMNA (0.57) | CYP2A6MAPTKDM4ELMNASMN1; SMN2 | |
| SCHEMBL9457966 | 0.71 | CYP19A1 (0.37) | S1PR1S1PR3KMT2AMEN1ALDH1A1 | |
| SCHEMBL9458299 | 0.71 | MAOB (0.35) | S1PR1S1PR3PTPN1KMT2AMEN1 | |
| SCHEMBL9458201 | 0.70 | OPRL1 (0.43) | MAPTKDM4ESMN1; SMN2ALDH1A1RAB9A |
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-5208259-A | Lipoxygenase enzyme inhibitors | IMPERIAL CHEMICAL INDUSTRIES (GB) | 1993-05-04 | — | — | US | disclosed |
| EP-0409413-A2 | Diaryl ether heterocycles | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-01-23 | — | — | EP | disclosed |