Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | LDHA | P00338 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | ANPEP | P15144 | 2/20 | 0.42 |
| ▸ | ERAP2 | Q6P179 | 2/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | AGXT | P21549 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11795802 | 0.87 | ALDH1A1 (0.50) | ALDH1A1LDHAKMT2AHTTMAPT | |
| SCHEMBL7282986 | 0.85 | POLB (0.49) | ALDH1A1KMT2APOLBSMN1; SMN2 | |
| SCHEMBL11387657 | 0.80 | ALDH1A1 (0.46) | ALDH1A1KMT2AHTTMAPTGLA | |
| SCHEMBL10458707 | 0.78 | ALDH1A1 (0.41) | ALDH1A1LDHAKMT2AHTTMAPT | |
| SCHEMBL10458826 | 0.78 | ALDH1A1 (0.44) | ALDH1A1KMT2AHTTMAPTGLA | |
| SCHEMBL5895663 | 0.78 | ALDH1A1 (0.41) | ALDH1A1HTTATMSMN1; SMN2MMP1 | |
| SCHEMBL11804852 | 0.77 | ALDH1A1 (0.43) | ALDH1A1LDHAKMT2AHTTMAPT | |
| SCHEMBL28888054 | 0.77 | ALDH1A1 (0.50) | ALDH1A1LDHAKMT2AHTTMAPT | |
| SCHEMBL28049332 | 0.76 | SLC6A4 (0.53) | ALDH1A1LDHAHTTMAPTIDO1 | |
| SCHEMBL5895627 | 0.75 | ALDH1A1 (0.49) | ALDH1A1KMT2AHTTMAPTGLA |
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 6 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-4258040-A | Cephalosporin compounds | MERCK & CO., INC. (US) | 1981-03-24 | — | — | US | disclosed |
| US-4226866-A | BACTERICIDES, ACYLATION | MERCK & CO., INC. (US) | 1980-10-07 | — | — | US | disclosed |
| US-4086423-A | CEPHALOSPORINS, CYCLOADDITION OF GLYCINE DERIVATIVE TO THIAZINE COMPOUND | MERCK & CO., INC. (US) | 1978-04-25 | — | — | US | disclosed |
| US-3962224-A | CHEMICAL INTERMEDIATES FOR ANTIBIOTICS | MERCK & CO., INC. (US) | 1976-06-08 | — | — | US | disclosed |
| US-3947413-A | ANTIBIOTICS | MERCK & CO., INC. (US) | 1976-03-30 | — | — | US | disclosed |