Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NSD2 | O96028 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | CASP6 | P55212 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | SELL | P14151 | 1/20 | 0.42 |
| ▸ | SELP | P16109 | 1/20 | 0.42 |
| ▸ | SELE | P16581 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10434111 | 0.82 | ACHE (0.43) | PTPN1ALDH1A1HPGDKDM4ENSD2 | |
| SCHEMBL27985290 | 0.82 | ACHE (0.38) | PTPN1ALDH1A1HPGDKDM4ENSD2 | |
| Tribromometacresol SCHEMBL30255705 | 0.82 | CA1 (0.52) | PTPN1ALDH1A1HPGDCA1CA2 | |
| Tribromometacresol SCHEMBL467297 | 0.82 | CA1 (0.52) | PTPN1ALDH1A1HPGDCA1CA2 | |
| SCHEMBL2051242 | 0.80 | CA1 (0.42) | ALDH1A1HPGDKDM4ENSD2LMNA | |
| SCHEMBL3123767 | 0.80 | PTPN1 (0.44) | PTPN1ALDH1A1HPGDKDM4ENSD2 | |
| SCHEMBL69446 | 0.76 | PTPN1 (0.56) | PTPN1ALDH1A1HPGDMAPK1CA1 | |
| SCHEMBL11882654 | 0.76 | PTPN1 (0.60) | PTPN1CA1CA2CA4CA6 | |
| SCHEMBL22112316 | 0.74 | ACHE (0.46) | ALDH1A1HPGDLMNAGAAHTT | |
| SCHEMBL4944868 | 0.73 | GABRA1 (0.54) | ALDH1A1HPGDLMNAGAABLM |
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-2017106861-A1 | COMPOSITIONS OF POLYHYDROXYLATED BENZOPHENONES AND METHODS OF TREATMENT OF NEURODEGENERATIVE DISORDERS | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2017-06-22 | — | — | WO | disclosed |