Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.47 |
| ▸ | GSK3A | P49840 | 1/20 | 0.47 |
| ▸ | GSK3B | P49841 | 1/20 | 0.47 |
| ▸ | SRC | P12931 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | PNP | P00491 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MIF | P14174 | 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 | |
|---|---|---|---|---|
| SCHEMBL1584775 | 0.83 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2KDM4ELMNAHTT | |
| SCHEMBL28287325 | 0.79 | HPGD (0.63) | ALDH1A1SMN1; SMN2KDM4EMEN1MAPT | |
| SCHEMBL11125362 | 0.77 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2KDM4EHTTMEN1 | |
| SCHEMBL4098207 | 0.76 | MEN1 (0.53) | ALDH1A1SMN1; SMN2KDM4ELMNAHTT | |
| SCHEMBL4164688 | 0.76 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2KDM4ELMNAHTT | |
| SCHEMBL15978138 | 0.75 | FPR1 (0.51) | ALDH1A1SMN1; SMN2KDM4ELMNAMEN1 | |
| Hydrogen Sulfide SCHEMBL27583639 | 0.75 | HPGD (0.50) | ALDH1A1SMN1; SMN2KDM4ELMNAHTT | |
| SCHEMBL11315740 | 0.75 | HPGD (0.50) | ALDH1A1SMN1; SMN2KDM4ELMNAHTT | |
| SCHEMBL5272693 | 0.74 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2KDM4ELMNAHTT | |
| SCHEMBL28160033 | 0.73 | HPGD (0.51) | ALDH1A1SMN1; SMN2KDM4ELMNAHTT |
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-2011046920-A1 | NOVEL DXR INHIBITORS FOR ANTIMICROBIAL THERAPY | BAYLOR COLLEGE OF MEDICINE (US) | 2011-04-21 | — | — | WO | disclosed |