Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | GAA | P10253 | 5/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | GLA | P06280 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 4/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6106931 | 0.91 | RXFP1 (0.33) | ALDH1A1GAATP53KMT2AMEN1 | |
| SCHEMBL6109839 | 0.89 | AAK1 (0.32) | ALDH1A1GAAKDM4ESMN1; SMN2TP53 | |
| SCHEMBL6109923 | 0.89 | THRA (0.32) | ALDH1A1GAAKDM4ESMN1; SMN2NPSR1 | |
| SCHEMBL6110442 | 0.88 | THRA (0.33) | KDM4ESMN1; SMN2HPGDCYP1A2CYP2C19 | |
| SCHEMBL6111468 | 0.86 | MAPK8 (0.38) | ALDH1A1KDM4EHSD17B10KMT2AMEN1 | |
| SCHEMBL6107056 | 0.86 | THRA (0.33) | ALDH1A1KDM4ETP53HSD17B10KMT2A | |
| SCHEMBL6109701 | 0.85 | ITGB1 (0.34) | ALDH1A1KDM4ESMN1; SMN2HPGDHSD17B10 | |
| SCHEMBL6108982 | 0.84 | AAK1 (0.33) | KDM4ESMN1; SMN2CNR2CNR1 | |
| SCHEMBL6110346 | 0.83 | DPP4 (0.39) | ALDH1A1 | |
| SCHEMBL6108948 | 0.82 | KMT2A (0.38) | ALDH1A1KDM4EGLASMN1; SMN2TP53 |
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-7034039-B2 | Fused heterocyclic compounds | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2006-04-25 | — | — | US | disclosed |