Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.35 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.32 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | CYP4B1 | P13584 | 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 | |
|---|---|---|---|---|
| SCHEMBL6047610 | 0.83 | NPC1 (0.35) | ALOX15MAPK14CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6047578 | 0.82 | CYP1A1 (0.42) | MAPK14CYP1A2CYP2C9CYP2C19CYP1A1 | |
| SCHEMBL6047634 | 0.81 | CYP1A1 (0.40) | KMT2AMAPK14CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6047650 | 0.80 | CYP24A1 (0.40) | MEN1ALOX15KMT2AMAPK14CYP1A2 | |
| SCHEMBL6047612 | 0.80 | MAOB (0.40) | MEN1KMT2AMAPK14CYP1A2CYP2C9 | |
| SCHEMBL6047630 | 0.79 | CYP3A4 (0.39) | MAPK14CYP1A2CYP2C9CYP2C19CYP1A1 | |
| SCHEMBL6047641 | 0.78 | ALKBH3 (0.34) | MEN1ALOX15KMT2ACYP1A2CYP2C9 | |
| SCHEMBL6047628 | 0.77 | ABL1 (0.47) | KMT2ANPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL6047580 | 0.74 | MAPT (0.42) | MEN1KMT2ANPC1ALDH1A1GAA | |
| SCHEMBL6047586 | 0.74 | CHRNA7 (0.35) | MEN1ALOX15KMT2ACHRM5CYP1A2 |
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 |