Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL11390682 | 0.81 | ELANE (0.50) | TDP1ELANEKMT2APOLBMEN1 | |
| SCHEMBL11398406 | 0.80 | ATM (0.39) | ATML3MBTL1TDP1ELANECYP1A2 | |
| SCHEMBL10458807 | 0.75 | ATM (0.45) | ATML3MBTL1TDP1ELANEKMT2A | |
| SCHEMBL711351 | 0.74 | GAA (0.52) | TDP1CYP1A2KMT2APOLBALDH1A1 | |
| SCHEMBL4690902 | 0.72 | POLB (0.57) | ELANECYP1A2KMT2APOLBALDH1A1 | |
| SCHEMBL11802708 | 0.72 | ALDH1A1 (0.49) | ATMKMT2APOLBALDH1A1GAA | |
| SCHEMBL6179815 | 0.71 | MAPK1 (0.50) | KMT2AMAPK1MAPTSMN1; SMN2MEN1 | |
| SCHEMBL11388122 | 0.70 | MEN1 (0.43) | TDP1ELANEKMT2AMEN1LMNA | |
| SCHEMBL11384976 | 0.70 | — | — | |
| SCHEMBL11395544 | 0.70 | DGAT1 (0.33) | LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4258040-A | Cephalosporin compounds | MERCK & CO., INC. (US) | 1981-03-24 | — | — | US | disclosed |
| US-4060687-A | Cephalosporins having a 3-α substituted alkyl grouping | MERCK & CO., INC. (US) | 1977-11-29 | — | — | US | disclosed |
| US-3947413-A | ANTIBIOTICS | MERCK & CO., INC. (US) | 1976-03-30 | — | — | US | disclosed |