Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.59 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.54 |
| ▸ | GLA | P06280 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 4/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | MAOA | P21397 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 2/20 | 0.53 |
| ▸ | PPM1A | P35813 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL6138950 | 0.88 | HPRT1 (0.66) | ALDH1A1KDM4ECYP1A2KMT2ASMN1; SMN2 | |
| SCHEMBL13609731 | 0.83 | ALDH1A1 (0.53) | ALDH1A1KDM4ECYP1A2KMT2ASMN1; SMN2 | |
| SCHEMBL9464673 | 0.82 | CDC25B (0.55) | ALDH1A1KDM4ECYP1A2SMN1; SMN2CYP2C19 | |
| SCHEMBL6691636 | 0.82 | POLB (0.57) | ALDH1A1KDM4ECYP1A2KMT2ASMN1; SMN2 | |
| SCHEMBL11662771 | 0.82 | MEN1 (0.59) | ALDH1A1KDM4ECYP1A2KMT2ASMN1; SMN2 | |
| SCHEMBL8982554 | 0.82 | KDM4E (0.63) | ALDH1A1KDM4ECYP1A2KMT2ACYP2D6 | |
| SCHEMBL7527927 | 0.82 | KDM4E (0.61) | ALDH1A1KDM4ECYP1A2KMT2ASMN1; SMN2 | |
| SCHEMBL14503713 | 0.81 | POLB (0.49) | ALDH1A1KDM4ECYP1A2KMT2ASMN1; SMN2 | |
| SCHEMBL31154593 | 0.78 | ALDH1A1 (0.58) | ALDH1A1KDM4ECYP1A2KMT2ASMN1; SMN2 | |
| SCHEMBL6138266 | 0.77 | MAPT (0.60) | ALDH1A1KDM4ECYP1A2KMT2ACYP2C19 |
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-20040126892-A1 | Methods for characterizing a mixture of chemical compounds | ADVANCED CHEMISTRY DEVELOPMENT (CA) | 2004-07-01 | — | — | US | disclosed |