Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 3/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA7 | P43166 | 2/20 | 0.34 |
| ▸ | PTPRB | P23467 | 1/20 | 0.34 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | APLNR | P35414 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 2/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL8627281 | 0.86 | NAALAD2 (0.42) | CA12CA14CA2TDP1CA1 | |
| SCHEMBL2258655 | 0.84 | DGAT1 (0.44) | DGAT1CA12CA14CA2TDP1 | |
| SCHEMBL2258658 | 0.84 | DGAT1 (0.44) | DGAT1CA12CA14CA2TDP1 | |
| SCHEMBL25202548 | 0.81 | CA12 (0.41) | DGAT1CA12CA14CA2TDP1 | |
| SCHEMBL29099898 | 0.81 | DGAT1 (0.41) | DGAT1CA12CA14CA2TDP1 | |
| SCHEMBL18109725 | 0.81 | DGAT1 (0.41) | DGAT1CA12CA14CA2TDP1 | |
| SCHEMBL18109728 | 0.81 | DGAT1 (0.41) | DGAT1CA12CA14CA2TDP1 | |
| SCHEMBL3936414 | 0.79 | DGAT1 (0.47) | DGAT1CA12CA14CA2TDP1 | |
| SCHEMBL3180767 | 0.79 | DGAT1 (0.47) | DGAT1CA12CA14CA2TDP1 | |
| SCHEMBL4549806 | 0.79 | DGAT1 (0.47) | DGAT1CA12CA14CA2TDP1 |
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-2009136144-A1 | PURINE DERIVATIVES SUITABLE FOR THE TREATMENT OF CANCER, AUTOIMMUNE AND INFLAMMATORY DISEASES | CHROMA THERAPEUTICS LTD (GB) | 2009-11-12 | — | — | WO | disclosed |