Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 5/20 | 0.60 |
| ▸ | HTR1B | P28222 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | CASP7 | P55210 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | KCNA3 | P22001 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | TOP2A | P11388 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | KDM5A | P29375 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5747324 | 0.88 | HTR1B (0.58) | MAOAHTR1BKDM4EKCNA3CYP2A6 | |
| SCHEMBL28198664 | 0.84 | MAOA (0.62) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL5746334 | 0.83 | HTR1B (0.53) | MAOAHTR1BKDM4EALDH1A1GLA | |
| SCHEMBL5749134 | 0.82 | MAOA (0.59) | MAOAHTR1B | |
| SCHEMBL5748462 | 0.82 | MAOA (0.59) | MAOAHTR1BKDM4EALDH1A1GLA | |
| SCHEMBL7359555 | 0.81 | MAOA (0.55) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL6893811 | 0.81 | MAOA (0.69) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL5745354 | 0.81 | MAOA (0.61) | MAOAHTR1BKDM4EALDH1A1GLA | |
| SCHEMBL5749472 | 0.81 | MAOA (0.61) | MAOAHTR1BKDM4EALDH1A1GLA | |
| SCHEMBL5798486 | 0.80 | XDH (0.65) | MAOAHTR1BALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1711463-A2 | AMINO-SUBSTITUTED TRICYCLIC DERIVATIVES AND METHODS OF USE | ABBOTT LABORATORIES (US) | 2006-10-18 | — | — | EP | disclosed |
| WO-2005077899-A2 | AMINO-SUBSTITUTED TRICYCLIC DERIVATIVES AND METHODS OF USE | ABBOTT LABORATORIES (US) | 2005-08-25 | — | — | WO | disclosed |