Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 2/20 | 0.64 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 5/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | ATR | Q13535 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | OR51E2 | Q9H255 | 2/20 | 0.41 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.41 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | LDHB | P07195 | 1/20 | 0.35 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.35 |
| ▸ | SUCNR1 | Q9BXA5 | 1/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | KDM5C | P41229 | 1/20 | 0.35 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.35 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Malonic Acid SCHEMBL8976510 | 0.87 | LDHA (0.56) | LDHASRRTSHRCYP1A2OR51E2 | |
| Malonic Acid SCHEMBL14742538 | 0.87 | LDHA (0.56) | LDHASRRTSHRCYP1A2OR51E2 | |
| Malonic Acid SCHEMBL6278226 | 0.85 | LDHA (0.75) | LDHASRRTSHRCYP1A2OR51E2 | |
| SCHEMBL2972384 | 0.83 | — | — | |
| Malonic Acid SCHEMBL28245910 | 0.81 | — | — | |
| Malonic Acid SCHEMBL17361230 | 0.81 | — | — | |
| Malonic Acid SCHEMBL4316213 | 0.81 | — | — | |
| Malonic Acid SCHEMBL11075565 | 0.81 | LDHA (0.82) | LDHASRRTSHRCYP1A2OR51E2 | |
| Malonic Acid SCHEMBL3358611 | 0.80 | — | — | |
| Malonic Acid SCHEMBL1332587 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998015545-A1 | NEW SEROTONIN 5-HT1F AGONISTS | ELI LILLY AND COMPANY (US) | 1998-04-16 | — | — | WO | disclosed |