Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.35 |
| ▸ | EED | O75530 | 1/20 | 0.35 |
| ▸ | PBK | Q96KB5 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CPN1 | P15169 | 1/20 | 0.33 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | HTR6 | P50406 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | EHMT2 | Q96KQ7 | 2/20 | 0.31 |
| ▸ | SYK | P43405 | 1/20 | 0.31 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL27886873 | 1.00 | TDP1 (0.38) | TDP1EPHX1BRD4ATAD2EED | |
| Tert-Butyl Formate SCHEMBL28294100 | 0.85 | TDP1 (0.41) | TDP1EPHX1EEDKMT2ACPN1 | |
| Tert-Butyl Formate SCHEMBL28133014 | 0.84 | TDP1 (0.46) | TDP1 | |
| Tert-Butyl Formate SCHEMBL27844874 | 0.84 | TDP1 (0.39) | TDP1EPHX1EEDKMT2ACPN1 | |
| Tert-Butyl Formate SCHEMBL27919819 | 0.84 | TDP1 (0.39) | TDP1EPHX1EEDKMT2ACPN1 | |
| Tert-Butyl Formate SCHEMBL27655747 | 0.84 | TDP1 (0.39) | TDP1EPHX1EEDKMT2ACPN1 | |
| Tert-Butyl Formate SCHEMBL27522712 | 0.84 | TDP1 (0.39) | TDP1EPHX1EEDKMT2ACPN1 | |
| Tert-Butyl Formate SCHEMBL27737964 | 0.84 | TDP1 (0.39) | TDP1EPHX1BRD4ATAD2EED | |
| Tert-Butyl Formate SCHEMBL27903707 | 0.84 | TDP1 (0.39) | TDP1EPHX1EEDKMT2ACPN1 | |
| Tert-Butyl Formate SCHEMBL27658298 | 0.84 | TDP1 (0.39) | TDP1EPHX1EEDKMT2ACPN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102884062-B | Aminopyrimidine inhibitors of kinases | 嘉世高制药公司 | 2016-08-03 | — | — | CN | disclosed |