Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 2/20 | 0.44 |
| ▸ | HTR1B | P28222 | 2/20 | 0.44 |
| ▸ | NR3C1 | P04150 | 9/20 | 0.40 |
| ▸ | DRD2 | P14416 | 3/20 | 0.39 |
| ▸ | PGR | P06401 | 5/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL6965840 | 0.85 | KCNH2 (0.48) | KCNH2HTR1AHTR1BNR3C1DRD2 | |
| SCHEMBL6964471 | 0.83 | DRD2 (0.54) | KCNH2HTR1AHTR1BNR3C1DRD2 | |
| SCHEMBL6960229 | 0.79 | DRD2 (0.54) | KCNH2HTR1AHTR1BDRD2MAOB | |
| SCHEMBL6967276 | 0.79 | DRD2 (0.55) | KCNH2HTR1AHTR1BNR3C1DRD2 | |
| SCHEMBL6966566 | 0.78 | KCNH2 (0.50) | KCNH2HTR1AHTR1BDRD2MAOB | |
| SCHEMBL6963230 | 0.76 | DRD2 (0.53) | KCNH2HTR1AHTR1BNR3C1DRD2 | |
| SCHEMBL5047902 | 0.76 | AOC3 (0.47) | HTR1AHTR1BMEN1NPC1ALDH1A1 | |
| SCHEMBL6961517 | 0.75 | DRD2 (0.54) | KCNH2HTR1AHTR1BNR3C1DRD2 | |
| SCHEMBL6966311 | 0.75 | KCNH2 (0.52) | KCNH2HTR1AHTR1BNR3C1DRD2 | |
| SCHEMBL6960921 | 0.74 | KCNH2 (0.49) | KCNH2NR3C1KDM4ENPC1ALDH1A1 |
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-6602889-B1 | 5-heteroaryl substituted indoles | H. LUNDBECK A.S. (DK) | 2003-08-05 | — | — | US | disclosed |
| EP-1068198-B1 | 5-HETEROARYL SUBSTITUTED INDOLES | LUNDBECK & CO AS H (DK) | 2003-05-28 | — | — | EP | disclosed |