Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.62 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 3/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | TSHR | P16473 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | KDM1A | O60341 | 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 | |
|---|---|---|---|---|
| SCHEMBL11483564 | 0.85 | KDM4E (0.62) | ALDH1A1KDM4ETP53HPGDPOLB | |
| SCHEMBL5327134 | 0.83 | ALDH1A1 (0.50) | ALDH1A1KDM4ETP53HPGDPOLB | |
| SCHEMBL8124409 | 0.79 | KDM4E (0.51) | ALDH1A1KDM4ETP53HPGDPOLB | |
| SCHEMBL11472275 | 0.78 | KCNN3 (0.50) | ALDH1A1KDM4ETP53HPGDCYP1A2 | |
| SCHEMBL11478689 | 0.76 | KDM4E (1.00) | ALDH1A1KDM4ETP53HPGDPOLB | |
| SCHEMBL12953521 | 0.75 | CDK2 (0.48) | ALDH1A1KDM4ETP53HPGDSMN1; SMN2 | |
| SCHEMBL13304976 | 0.75 | IDO1 (0.42) | ALDH1A1KDM4EHPGDSMN1; SMN2TSHR | |
| SCHEMBL14626100 | 0.74 | KDM4E (0.50) | ALDH1A1KDM4ETP53HPGDPOLB | |
| SCHEMBL5329221 | 0.74 | KDM4E (0.49) | ALDH1A1KDM4ETP53HPGDPOLB | |
| SCHEMBL14626235 | 0.74 | KDM4E (0.49) | ALDH1A1KDM4ETP53HPGDPOLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007011759-A2 | INHIBITORS OF MITOTIC KINESIN | KALYPSYS, INC. (US) | 2007-01-25 | — | — | WO | disclosed |
| US-4209621-A | TRANQUILIZERS | AMERICAN CYANAMID COMPANY (US) | 1980-06-24 | — | — | US | disclosed |