Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP24A1 | Q07973 | 2/20 | 0.40 |
| ▸ | CYP27A1 | Q02318 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.37 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6047626 | 0.83 | NPC1 (0.36) | MAPTPDK2MEN1KMT2ACYP1A2 | |
| SCHEMBL6047656 | 0.82 | HCRTR1 (0.36) | PDK2 | |
| SCHEMBL6047648 | 0.81 | NAAA (0.42) | THRATHRBCYP1A2CYP2C19CYP3A4 | |
| SCHEMBL6047643 | 0.80 | P2RX7 (0.37) | MAPK14THRATHRBMEN1KMT2A | |
| SCHEMBL6047659 | 0.80 | THRA (0.39) | THRATHRBAKR1C4AKR1C3AKR1C2 | |
| SCHEMBL6047633 | 0.79 | PTPN1 (0.36) | MAPTCYP1A2CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL6047596 | 0.78 | ABL1 (0.45) | LMNAMAPTMEN1KMT2ACYP3A4 | |
| SCHEMBL6047600 | 0.77 | ACHE (0.39) | LMNAMAPTTDP1THRATHRB | |
| SCHEMBL6047613 | 0.76 | THRA (0.39) | LMNAMAPTTHRATHRBCYP1A2 | |
| SCHEMBL6047602 | 0.76 | NAAA (0.37) | MAPK14MAPTTHRATHRBCYP1A2 |
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 |