Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 2/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL478210 | 0.83 | LMNA (0.33) | LMNACYP2C19 | |
| SCHEMBL11085863 | 0.79 | CYP2C9 (0.38) | LMNACYP2C19NOS1NOS3NOS2 | |
| SCHEMBL2034964 | 0.79 | SMN1; SMN2 (0.37) | LMNACYP2C19CA12CA14KMT2A | |
| SCHEMBL27963220 | 0.78 | LMNA (0.38) | LMNACYP2C19DGAT1NOS1NOS3 | |
| SCHEMBL10457033 | 0.77 | HMGCR (0.35) | NOS1NOS3NOS2 | |
| SCHEMBL190856 | 0.74 | CA12 (0.37) | LMNACYP2C19DGAT1CA12CA14 | |
| SCHEMBL10458237 | 0.72 | LMNA (0.32) | LMNACYP2C19 | |
| SCHEMBL19102803 | 0.72 | LMNA (0.38) | LMNACYP2C19 | |
| SCHEMBL2462786 | 0.72 | SLC1A3 (0.39) | LMNACYP2C19 | |
| SCHEMBL1353684 | 0.71 | NOS1 (0.39) | LMNACYP2C19DGAT1NOS1NOS3 |
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 5 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-4937331-A | Chemical intermediates for antibiotics | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 1990-06-26 | — | — | US | disclosed |
| EP-0334593-A1 | Chiral azetidinone epoxides | THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 1989-09-27 | — | — | EP | 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 |