Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.40 |
| ▸ | EGFR | P00533 | 6/20 | 0.39 |
| ▸ | FYN | P06241 | 3/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CSF1R | P07333 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.34 |
| ▸ | MLYCD | O95822 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL899302 | 0.89 | CCNE1 (0.42) | HDAC1CCNE1CDK2CDK5KDM4E | |
| SCHEMBL899084 | 0.86 | KCNH2 (0.38) | HDAC1CCNE1CDK2CDK5TSHR | |
| SCHEMBL899508 | 0.86 | HDAC1 (0.47) | HDAC1CCNE1CDK2CDK5CYP3A4 | |
| SCHEMBL899366 | 0.82 | HSD17B2 (0.46) | HDAC1TSHR | |
| SCHEMBL902944 | 0.81 | HDAC1 (0.38) | HDAC1KDM4EALDH1A1 | |
| SCHEMBL898826 | 0.81 | XDH (0.48) | CYP3A4KDM4EALDH1A1 | |
| SCHEMBL899484 | 0.76 | ALDH1A1 (0.38) | TSHRKDM4EALDH1A1 | |
| SCHEMBL899467 | 0.76 | ALDH1A1 (0.44) | KDM4EALDH1A1CYP19A1 | |
| SCHEMBL10045592 | 0.75 | ALDH1A1 (0.39) | EGFRTSHRCYP3A4KDM4EALDH1A1 | |
| SCHEMBL899268 | 0.73 | KCNA3 (0.37) | TSHRKDM4EALDH1A1CYP19A1MLYCD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012040754-A2 | NOVEL THIAZOLAMINE DERIVATES AS DIFFERENTIATION ACCELERATORS | TECHNISCHE UNIVERSITÄT WIEN (AT) | 2012-04-05 | — | — | WO | disclosed |