Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | P4HB | P07237 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13304673 | 0.91 | ALDH1A1 (0.57) | ALDH1A1TSHRSIGMAR1RAB9AP4HB | |
| SCHEMBL3255205 | 0.90 | ALDH1A1 (0.49) | ALDH1A1TSHRSIGMAR1RAB9AP4HB | |
| SCHEMBL3251466 | 0.83 | MAOA (0.51) | ALDH1A1TSHRSIGMAR1RAB9AHSD17B10 | |
| SCHEMBL3252425 | 0.82 | SIGMAR1 (0.50) | ALDH1A1TSHRSIGMAR1RAB9AHSD17B10 | |
| SCHEMBL3246823 | 0.81 | SIGMAR1 (0.73) | ALDH1A1TSHRSIGMAR1RAB9AP4HB | |
| SCHEMBL3256385 | 0.81 | XDH (0.51) | ALDH1A1TSHRSIGMAR1RAB9AHSD17B10 | |
| SCHEMBL3255333 | 0.81 | ALDH1A1 (0.58) | ALDH1A1TSHRSIGMAR1RAB9AP4HB | |
| SCHEMBL3252274 | 0.76 | ALDH1A1 (0.76) | ALDH1A1TSHRSIGMAR1RAB9AHSD17B10 | |
| SCHEMBL3252433 | 0.73 | ALDH1A1 (0.57) | ALDH1A1TSHRSIGMAR1RAB9AHSD17B10 | |
| SCHEMBL3253325 | 0.72 | ALDH1A1 (0.56) | ALDH1A1TSHRSIGMAR1RAB9AHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1890672-B1 | USE OF CHROMONE DERIVATIVES | MERCK PATENT GMBH (DE) | 2010-06-02 | — | — | EP | disclosed |