Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TET2 | Q6N021 | 3/20 | 0.35 |
| ▸ | KDM4A | O75164 | 2/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.35 |
| ▸ | KDM2A | Q9Y2K7 | 2/20 | 0.35 |
| ▸ | TET3 | O43151 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1533908 | 0.79 | OR51E2 (0.46) | SMN1; SMN2SLC22A6TSHRCYP2C9OR51E2 | |
| SCHEMBL1332210 | 0.79 | OR51E2 (0.46) | SMN1; SMN2SLC22A6TSHRCYP2C9OR51E2 | |
| SCHEMBL28231517 | 0.78 | CYP2C9 (0.37) | SMN1; SMN2TSHRCYP2C9OR51E2 | |
| Malic Acid SCHEMBL10703292 | 0.78 | SMN1; SMN2 (0.83) | SMN1; SMN2SLC22A6GABRR1LMNAOR51E2 | |
| Malic Acid SCHEMBL5202567 | 0.78 | SMN1; SMN2 (0.83) | SMN1; SMN2SLC22A6GABRR1LMNAOR51E2 | |
| SCHEMBL5542149 | 0.76 | ALDH1A1 (0.43) | SMN1; SMN2TSHRCYP2C9OR51E2TDP1 | |
| Malic Acid SCHEMBL28171920 | 0.74 | SMN1; SMN2 (0.88) | SMN1; SMN2SLC22A6GABRR1LMNAOR51E2 | |
| SCHEMBL4360901 | 0.74 | TSHR (0.50) | SMN1; SMN2SLC22A6TSHRCYP2C9GABRR1 | |
| SCHEMBL10581351 | 0.74 | SMN1; SMN2 (0.52) | SMN1; SMN2SLC22A6GABRR1LMNATDP1 | |
| SCHEMBL27216228 | 0.74 | TSHR (0.50) | SMN1; SMN2SLC22A6TSHRCYP2C9GABRR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4957912-A | ANTIBIOTICS | MERCK & CO., INC. (US) | 1990-09-18 | — | — | US | disclosed |
| US-4226866-A | BACTERICIDES, ACYLATION | MERCK & CO., INC. (US) | 1980-10-07 | — | — | US | disclosed |