Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MYC | P01106 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | ALPL | P05186 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 3/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| 3-Coumaranone SCHEMBL28237724 | 0.81 | MAPT (0.51) | PARP1ALDH1A1HSD17B10KDM4EALPL | |
| 3-Coumaranone SCHEMBL69412 | 0.79 | PKM (0.56) | ALDH1A1HSD17B10KDM4EMAPTMEN1 | |
| 3-Coumaranone SCHEMBL29420742 | 0.79 | PKM (0.56) | ALDH1A1HSD17B10KDM4EMAPTMEN1 | |
| Acetic Acid SCHEMBL8221392 | 0.76 | HSD17B10 (0.44) | PARP1ALDH1A1HSD17B10KDM4EALPL | |
| 3-Coumaranone SCHEMBL28237723 | 0.76 | MAPT (0.47) | PARP1ALDH1A1HSD17B10KDM4EALPL | |
| Phthalic Anhydride SCHEMBL27958781 | 0.76 | MYC (0.53) | MYCALDH1A1HSD17B10KDM4EMAPT | |
| SCHEMBL20510040 | 0.74 | PARP1 (0.73) | MYCPARP1ALDH1A1HSD17B10KDM4E | |
| Cyclohexane SCHEMBL27551130 | 0.73 | TSHR (0.53) | MYCALDH1A1HSD17B10KDM4EMAPT | |
| Cyclohexane SCHEMBL28181071 | 0.73 | TSHR (0.53) | MYCALDH1A1HSD17B10KDM4EMAPT | |
| SCHEMBL756585 | 0.73 | TSHR (0.61) | MYCALDH1A1HSD17B10KDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-103965147-B | Benzofuran derivatives | 武田药品工业株式会社 | 2016-08-24 | — | — | CN | disclosed |