Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | LCK | P06239 | 10/20 | 0.36 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8761670 | 1.00 | CA1 (0.41) | CA1CA2LCKPSMB8NPC1 | |
| SCHEMBL9122699 | 0.87 | CA1 (0.40) | CA1CA2LCKPSMB8NPC1 | |
| SCHEMBL9122704 | 0.87 | CA1 (0.40) | CA1CA2LCKPSMB8NPC1 | |
| SCHEMBL8573875 | 0.86 | ALOX5 (0.36) | NPC1LMNAPOLBRAB9ASMN1; SMN2 | |
| SCHEMBL8573869 | 0.86 | ALOX5 (0.36) | NPC1LMNAPOLBRAB9ASMN1; SMN2 | |
| SCHEMBL11259482 | 0.85 | CA1 (0.38) | CA1CA2LCKPSMB8 | |
| SCHEMBL11253247 | 0.84 | CA1 (0.38) | CA1CA2LCKPSMB8NPC1 | |
| SCHEMBL9121665 | 0.83 | CA1 (0.45) | CA1CA2LCKPSMB8NPC1 | |
| SCHEMBL31337188 | 0.83 | CA1 (0.50) | CA1CA2LCKPSMB8NPC1 | |
| SCHEMBL5148637 | 0.83 | CA1 (0.39) | CA1CA2LCKPSMB8NPC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0590681-B1 | A process for the preparation of aminothiadiazolylacetyl halide derivatives | EISAI KAGAKU KK (JP) | 1997-07-09 | — | — | EP | disclosed |
| EP-0691343-A1 | CEPHALOSPORIN DERIVATIVE | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1996-01-10 | — | — | EP | disclosed |
| US-5428173-A | Halogenating corresponding aminothiadiazolylacetic acid | EISAI CHEMICAL CO., LTD. (JP) | 1995-06-27 | — | — | US | disclosed |
| EP-0590681-A2 | A process for the preparation of aminothiadiazolylacetyl halide derivatives | EISAI CHEMICAL CO., LTD. (JP) | 1994-04-06 | — | — | EP | disclosed |