Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA4 | P22748 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 4/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5194718 | 0.80 | CA1 (0.48) | CA1CA2CA4KMT2AALDH1A1 | |
| SCHEMBL181970 | 0.76 | — | — | |
| SCHEMBL1568359 | 0.76 | — | — | |
| SCHEMBL6912662 | 0.76 | — | — | |
| SCHEMBL7871650 | 0.75 | CA1 (0.48) | CA1CA2CA4KMT2AALDH1A1 | |
| SCHEMBL29034973 | 0.74 | CA1 (0.37) | CA1CA2CA4KMT2AALDH1A1 | |
| SCHEMBL6916176 | 0.74 | KMT2A (0.52) | CA1CA2CA4KMT2AALDH1A1 | |
| SCHEMBL9874961 | 0.74 | KMT2A (0.52) | CA1CA2CA4KMT2AALDH1A1 | |
| SCHEMBL17183895 | 0.73 | MAOA (0.35) | CA1CA2CA4KMT2AALDH1A1 | |
| Hydrochloric Acid SCHEMBL8391553 | 0.72 | CA1 (0.46) | CA1CA2CA4KMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-3931324-A | FROM A 1,1-BIS(HYDROCARBYLPEROXY) CYCLOALKANE AND CYCLOALKANONE, MOLYBDENUM CONTAINING CATALYST | ATLANTIC RICHFIELD COMPANY (US) | 1976-01-06 | — | — | US | claimed |
| US-6720439-B1 | EFFICIENT REDUCTION OF BASE SENSITIVE CARBONYL COMPOUNDS; SEPARATING RACEMIC CARBONYL COMPOUNDS; CHIRAL CATALYSTS | NAGOYA INDUSTRIAL SCIENCE RESEARCH INSTITUTE (JP) | 2004-04-13 | — | — | US | disclosed |
| US-3935182-A | Water-soluble quaternary ammonium heterocyclic azo dyestuffs | STERLING DRUG INC. (US) | 1976-01-27 | — | — | US | disclosed |
| US-3931324-A | FROM A 1,1-BIS(HYDROCARBYLPEROXY) CYCLOALKANE AND CYCLOALKANONE, MOLYBDENUM CONTAINING CATALYST | ATLANTIC RICHFIELD COMPANY (US) | 1976-01-06 | — | — | US | disclosed |