Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 2/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 3/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 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 | |
|---|---|---|---|---|
| SCHEMBL5781630 | 0.83 | NUDT1 (0.35) | HTR2CALOX5PGRTAAR1CHRNB4 | |
| SCHEMBL4156196 | 0.80 | GALR1 (0.32) | HTR2CPGRIDO1NOTUM | |
| SCHEMBL6047634 | 0.77 | CYP1A1 (0.40) | ALOX5RELAMAOB | |
| SCHEMBL4808757 | 0.77 | ESR2 (0.39) | HTR2CALOX5PGRTAAR1ESR2 | |
| SCHEMBL4006209 | 0.75 | HTR2C (0.39) | HTR2CALOX5TAAR1CHRNB4CHRNA3 | |
| SCHEMBL6047606 | 0.69 | NR1I3 (0.39) | NOTUMNPC1TP53TSHRNFKB1 | |
| SCHEMBL31222672 | 0.68 | ALOX5 (0.65) | ALOX5PGRTAAR1IDO1ESR2 | |
| SCHEMBL817554 | 0.68 | ALOX5 (0.65) | ALOX5PGRTAAR1IDO1ESR2 | |
| SCHEMBL4145649 | 0.68 | ALOX5 (0.38) | HTR2CALOX5TAAR1CHRNB4CHRNA3 | |
| SCHEMBL4012821 | 0.67 | ESR2 (0.36) | ALOX5ESR2NOTUMNPC1TP53 |
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 |