Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | PSEN1 | P49768 | 3/20 | 0.36 |
| ▸ | PSEN2 | P49810 | 3/20 | 0.36 |
| ▸ | APH1B | Q8WW43 | 3/20 | 0.36 |
| ▸ | NCSTN | Q92542 | 3/20 | 0.36 |
| ▸ | APH1A | Q96BI3 | 3/20 | 0.36 |
| ▸ | PSENEN | Q9NZ42 | 3/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | TLR4 | O00206 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.32 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13135960 | 0.87 | KDM4E (0.39) | ALDH1A1KDM4EPSEN1PSEN2APH1B | |
| SCHEMBL7421794 | 0.78 | BTK (0.44) | ALDH1A1HDAC6CA1CA2 | |
| SCHEMBL1114653 | 0.77 | CCR2 (0.40) | BACE1HDAC3HDAC1HDAC2HDAC10 | |
| SCHEMBL1272610 | 0.77 | CRBN (0.36) | ALDH1A1CA1CA2CA4 | |
| SCHEMBL24885974 | 0.76 | KMT2A (0.38) | ALDH1A1BACE1CA1CA2CA4 | |
| SCHEMBL1114759 | 0.76 | CCR2 (0.53) | CCR2 | |
| SCHEMBL4639716 | 0.75 | CCR2 (0.36) | HTTCCR2 | |
| SCHEMBL7421087 | 0.74 | NAAA (0.46) | HTT | |
| SCHEMBL7570851 | 0.73 | SMN1; SMN2 (0.44) | ALDH1A1HDAC3HDAC1HDAC2HDAC10 | |
| SCHEMBL24886323 | 0.73 | ALDH1A1 (0.36) | ALDH1A1BACE1CA1CA2CA4 |
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-5648521-A | DECYCLIZATION, OXIDATION | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-07-15 | — | — | US | disclosed |