Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 7/20 | 0.59 |
| ▸ | NR0B2 | Q15466 | 3/20 | 0.59 |
| ▸ | RARB | P10826 | 5/20 | 0.58 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.56 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.56 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.56 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.56 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.56 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.56 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.56 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.56 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.56 |
| ▸ | TTR | P02766 | 1/20 | 0.53 |
| ▸ | DPP4 | P27487 | 1/20 | 0.53 |
| ▸ | RARA | P10276 | 2/20 | 0.49 |
| ▸ | RARG | P13631 | 2/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2392375 | 0.92 | PTPN11 (0.55) | PTPN11NR0B2RARBHDAC2HDAC11 | |
| SCHEMBL2391569 | 0.92 | PTPN11 (0.60) | PTPN11NR0B2RARBHDAC2HDAC11 | |
| SCHEMBL2391129 | 0.92 | MAOB (0.55) | PTPN11NR0B2RARBHDAC2HDAC11 | |
| SCHEMBL2395878 | 0.91 | PTPN11 (0.58) | PTPN11NR0B2RARBHDAC2HDAC11 | |
| SCHEMBL2391090 | 0.91 | PTPN11 (0.74) | PTPN11NR0B2RARBHDAC2HDAC11 | |
| SCHEMBL27619799 | 0.88 | RARB (0.58) | PTPN11NR0B2RARBHDAC2HDAC11 | |
| SCHEMBL2393224 | 0.88 | RARB (0.58) | PTPN11NR0B2RARBHDAC2HDAC11 | |
| SCHEMBL12531342 | 0.86 | RARB (0.56) | PTPN11NR0B2RARBHDAC2HDAC11 | |
| SCHEMBL2391357 | 0.86 | HDAC11 (0.47) | PTPN11NR0B2RARBHDAC2HDAC11 | |
| SCHEMBL2390145 | 0.86 | RARB (0.55) | PTPN11NR0B2RARBHDAC2HDAC11 |
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 |
|---|---|---|---|---|---|---|---|
| US-RE42700-E1 | Induction of apoptosis in cancer cells | SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) | 2011-09-13 | — | — | US | disclosed |