Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | IDH1 | O75874 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | NAAA | Q02083 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 2/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6047600 | 0.91 | ACHE (0.39) | PTPN1LTA4HSMN1; SMN2NAAAKDM4E | |
| SCHEMBL6047648 | 0.88 | NAAA (0.42) | PTPN1LTA4HNAAACYP1A2CYP3A4 | |
| SCHEMBL6047602 | 0.83 | NAAA (0.37) | PTPN1LTA4HSMN1; SMN2NAAAKDM4E | |
| SCHEMBL6047613 | 0.83 | THRA (0.39) | PTPN1SMN1; SMN2NAAAKDM4EMAPT | |
| SCHEMBL6047656 | 0.82 | HCRTR1 (0.36) | PTPN1NAAAHDAC8GRIN2BL3MBTL1 | |
| SCHEMBL6047594 | 0.81 | NAAA (0.40) | PTPN1LTA4HSMN1; SMN2NAAAKDM4E | |
| SCHEMBL6047659 | 0.81 | THRA (0.39) | PTPN1NAAABACE1 | |
| SCHEMBL6047596 | 0.80 | ABL1 (0.45) | PTPN1LTA4HSMN1; SMN2NAAAKDM4E | |
| SCHEMBL6047642 | 0.80 | MAOB (0.42) | PTPN1KDM4EHDAC8MAPTMAOB | |
| SCHEMBL6047590 | 0.79 | MEN1 (0.41) | SMN1; SMN2MAPTMAOBALDH1A1CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2006501194-A | — | — | 2006-01-12 | — | — | JP | claimed |
| EP-1525190-A1 | CCK-1 RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2005-04-27 | — | — | EP | claimed |
| WO-2004007463-A1 | CCK-1 RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA, N.V. (BE) | 2004-01-22 | — | — | WO | claimed |