Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL992319 | 0.78 | ALDH1A1 (0.57) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL9383761 | 0.78 | ALDH1A1 (0.63) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL18675779 | 0.78 | ALDH1A1 (0.52) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL15094083 | 0.77 | ALDH1A1 (0.61) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL3075549 | 0.77 | ALDH1A1 (0.50) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL1549936 | 0.75 | ALDH1A1 (0.64) | ALDH1A1KMT2ATDP1MAPK1L3MBTL1 | |
| SCHEMBL21500347 | 0.75 | ALDH1A1 (0.53) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL7054639 | 0.75 | ALDH1A1 (0.59) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL5969412 | 0.74 | ALDH1A1 (0.53) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL320969 | 0.74 | ALDH1A1 (0.52) | ALDH1A1KMT2ACA12CA1CA2 |
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-4335043-A | Substituted N-methylene derivatives of thienamycin | MERCK & CO., INC. (US) | 1982-06-15 | — | — | US | disclosed |
| US-4232030-A | ANTIBIOTICS | MERCK & CO., INC. (US) | 1980-11-04 | — | — | US | disclosed |
| US-4194047-A | Substituted N-methylene derivatives of thienamycin | MERCK & CO., INC. (US) | 1980-03-18 | — | — | US | disclosed |