Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 6/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | GLA | P06280 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8623689 | 0.85 | MAOA (0.46) | MAOAALDH1A1GLAKDM4ECYP3A4 | |
| SCHEMBL11029477 | 0.81 | MAOA (0.68) | MAOAALDH1A1KDM4ECYP3A4TDP1 | |
| SCHEMBL31060715 | 0.81 | MAOA (0.68) | MAOAALDH1A1KDM4ECYP3A4TDP1 | |
| SCHEMBL25137182 | 0.79 | ALDH1A1 (0.48) | MAOAALDH1A1GLACYP3A4SMN1; SMN2 | |
| SCHEMBL6893811 | 0.79 | MAOA (0.69) | MAOAALDH1A1GLAKDM4ECYP3A4 | |
| SCHEMBL9535409 | 0.78 | CYP2A6 (0.62) | ALDH1A1GLAKDM4ECYP3A4SMN1; SMN2 | |
| SCHEMBL11030589 | 0.78 | MAOA (0.62) | MAOAMGAMGAASIMGAM2 | |
| SCHEMBL7329771 | 0.77 | MAOA (0.58) | MAOAALDH1A1CYP3A4SMN1; SMN2TDP1 | |
| SCHEMBL4914778 | 0.76 | MAOA (0.61) | MAOAALDH1A1GLAKDM4ECYP3A4 | |
| SCHEMBL21874395 | 0.76 | MAOA (0.75) | MAOAALDH1A1GLAKDM4ECYP3A4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5741813-A | ADMINISTERING SUBSTITUTED XANTHONES | NATIONAL SCIENCE COUNCIL (TW) | 1998-04-21 | — | — | US | disclosed |