Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 2/20 | 0.56 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.37 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.37 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | KDM5C | P41229 | 1/20 | 0.32 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.32 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | LDHB | P07195 | 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 | |
|---|---|---|---|---|
| Malonic Acid SCHEMBL8707685 | 0.87 | LDHA (0.64) | LDHASRRCYP1A2GLRA1SLC6A9 | |
| Glycine SCHEMBL10934156 | 0.81 | — | — | |
| Malonic Acid SCHEMBL14742538 | 0.81 | LDHA (0.56) | LDHASRRCYP1A2GLRA1SLC6A9 | |
| SCHEMBL8715816 | 0.80 | — | — | |
| Malonic Acid SCHEMBL6278226 | 0.79 | LDHA (0.75) | LDHASRRCYP1A2GLRA1SLC6A9 | |
| Carbamic Acid SCHEMBL10800777 | 0.79 | — | — | |
| SCHEMBL2972384 | 0.78 | — | — | |
| Glycine SCHEMBL28823271 | 0.77 | GLRA1 (0.56) | CYP1A2GLRA1SLC6A9OR51E2ACHE | |
| Sarcosine SCHEMBL6755186 | 0.76 | ALDH1A1 (0.35) | LDHASRRCYP1A2TAS2R38ALDH1A1 | |
| Malonic Acid SCHEMBL17361230 | 0.75 | — | — |
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-5496929-A | MEDICAL DIAGNOSIS IMAGES FOR BRAINS AND BLOOD | CIS BIO INTERNATIONAL (FR) | 1996-03-05 | — | — | US | disclosed |