Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 5/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.65 |
| ▸ | TP53 | P04637 | 3/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | RAB9A | P51151 | 6/20 | 0.56 |
| ▸ | NPC1 | O15118 | 5/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | HTT | P42858 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | PKM | P14618 | 2/20 | 0.56 |
| ▸ | SCN4A | P35499 | 2/20 | 0.56 |
| ▸ | GMNN | O75496 | 1/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.56 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL11810178 | 0.86 | CYP3A4 (0.62) | CA2CYP3A4CYP1A2CYP2C19TP53 | |
| SCHEMBL27866435 | 0.84 | CYP3A4 (0.63) | CA2CYP3A4CYP1A2CYP2C19TP53 | |
| SCHEMBL28849832 | 0.82 | CA2 (0.70) | CA2CYP3A4CYP1A2CYP2C19TP53 | |
| SCHEMBL10531693 | 0.82 | CA2 (0.63) | CA2CYP3A4CYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL30944282 | 0.81 | CYP3A4 (0.69) | CA2CYP3A4CYP1A2CYP2C19TP53 | |
| SCHEMBL3042970 | 0.81 | APP (0.70) | CA2TP53ALDH1A1RAB9ANPC1 | |
| SCHEMBL7924838 | 0.80 | CA2 (1.00) | CA2LMNAPKMKMT2AKDM4E | |
| Riluzole SCHEMBL4443848 | 0.79 | RAB9A (0.82) | CYP3A4CYP1A2CYP2C19TP53HSD17B10 | |
| SCHEMBL29683488 | 0.79 | CYP3A4 (1.00) | CYP3A4CYP1A2CYP2C19TP53HSD17B10 | |
| SCHEMBL22358 | 0.79 | CYP3A4 (1.00) | CYP3A4CYP1A2CYP2C19TP53HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115109011-B | Benzothiazole compound, preparation method and application | 河北师范大学 | 2023-12-15 | — | — | CN | disclosed |
| CN-115109011-A | Benzothiazole compound, preparation method and application | 河北师范大学 | 2022-09-27 | — | — | CN | disclosed |
| CN-101448843-B | Imidazolothiazole compounds for the treatment of disease | AMBIT BIOSCIENCES CORP | 2012-05-09 | — | — | CN | disclosed |
| CN-101448843-A | Imidazolothiazole compounds for the treatment of disease | AMBIT BIOSCIENCES CORP (US) | 2009-06-03 | — | — | CN | disclosed |