Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | POLA1 | P09884 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 2/20 | 0.38 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.36 |
| ▸ | MGMT | P16455 | 2/20 | 0.36 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.35 |
| ▸ | CDK7 | P50613 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | CCNH | P51946 | 1/20 | 0.35 |
| ▸ | BRAF | P15056 | 1/20 | 0.34 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.34 |
| ▸ | MAP3K6 | O95382 | 1/20 | 0.34 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CTSA | P10619 | 1/20 | 0.32 |
| ▸ | XDH | P47989 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7771676 | 0.81 | ALDH1A1 (0.50) | KDM4EALDH1A1RXFP1POLA1CDK2 | |
| SCHEMBL14125940 | 0.80 | KDM4E (0.46) | KDM4EALDH1A1RXFP1BRAFTP53 | |
| SCHEMBL788098 | 0.80 | ALDH1A1 (0.52) | KDM4EALDH1A1RXFP1POLA1CDK2 | |
| SCHEMBL30556758 | 0.78 | ALDH1A1 (0.50) | KDM4EALDH1A1RXFP1POLA1CDK2 | |
| SCHEMBL29599053 | 0.78 | RXFP1 (0.51) | KDM4EALDH1A1RXFP1POLA1CDK2 | |
| SCHEMBL1721311 | 0.78 | ALDH1A1 (0.55) | KDM4EALDH1A1RXFP1POLA1CDK2 | |
| SCHEMBL28011628 | 0.78 | CDK2 (0.46) | KDM4EALDH1A1RXFP1POLA1CDK2 | |
| SCHEMBL30119558 | 0.77 | ALDH1A1 (0.46) | KDM4EALDH1A1RXFP1POLA1CDK2 | |
| SCHEMBL28339944 | 0.76 | ALDH1A1 (0.45) | KDM4EALDH1A1RXFP1POLA1CDK2 | |
| SCHEMBL28190667 | 0.75 | ALDH1A1 (0.47) | KDM4EALDH1A1RXFP1POLA1CDK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114096250-A | Novel therapy for erythropoietic protoporphyrinopathy (EPP) and X-linked protoporphyrinopathy (XLP) | 匹兹堡大学联邦高等教育系统 | 2022-02-25 | — | — | CN | disclosed |