Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VNN1 | O95497 | 9/20 | 0.43 |
| ▸ | CCR2 | P41597 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | CSF1R | P07333 | 2/20 | 0.37 |
| ▸ | BRAF | P15056 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21962852 | 0.83 | VNN1 (0.43) | VNN1CCR2KCNH2KMT2ATSHR | |
| SCHEMBL22020044 | 0.83 | VNN1 (0.43) | VNN1CCR2KCNH2KMT2ATSHR | |
| SCHEMBL21962720 | 0.81 | CCR2 (0.47) | VNN1CCR2KCNH2KMT2ATSHR | |
| SCHEMBL22019140 | 0.78 | CCR2 (0.47) | VNN1CCR2KCNH2KMT2ATSHR | |
| SCHEMBL21962773 | 0.78 | CCR2 (0.47) | VNN1CCR2KCNH2KMT2ATSHR | |
| SCHEMBL21962546 | 0.75 | VNN1 (0.42) | VNN1CCR2KMT2AALDH1A1POLB | |
| SCHEMBL22019130 | 0.75 | VNN1 (0.42) | VNN1CCR2KMT2AALDH1A1POLB | |
| SCHEMBL21962533 | 0.73 | SRD5A2 (0.41) | VNN1KMT2AMEN1HSD17B10ALDH1A1 | |
| SCHEMBL21962451 | 0.73 | MEN1 (0.41) | VNN1CCR2KCNH2KMT2AMEN1 | |
| SCHEMBL22019136 | 0.72 | SRD5A2 (0.43) | VNN1KMT2AMEN1HSD17B10BRAF |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020102575-A1 | HETEROCYCLIC AMINOTHIAZOLES AND USES THEREOF | INCEPTION IBD, INC. (US) | 2020-05-22 | — | — | WO | claimed |
| WO-2020102575-A1 | HETEROCYCLIC AMINOTHIAZOLES AND USES THEREOF | INCEPTION IBD, INC. (US) | 2020-05-22 | — | — | WO | disclosed |
| WO-2020102575-A1 | HETEROCYCLIC AMINOTHIAZOLES AND USES THEREOF | INCEPTION IBD, INC. (US) | 2020-05-22 | — | — | WO | disclosed |