Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9797052 | 0.89 | ALDH1A1 (0.42) | HTTKDM4EALDH1A1SMN1; SMN2NPSR1 | |
| SCHEMBL9879042 | 0.85 | HTT (0.40) | HTTKDM4EALDH1A1L3MBTL1CYP2C9 | |
| SCHEMBL8515731 | 0.79 | KDM4E (0.60) | HTTKDM4EALDH1A1L3MBTL1CYP2C9 | |
| SCHEMBL9879081 | 0.76 | HTT (0.49) | HTTKDM4EALDH1A1L3MBTL1CYP2C9 | |
| SCHEMBL10870260 | 0.76 | HTT (0.38) | HTTKDM4EALDH1A1L3MBTL1CYP2C9 | |
| SCHEMBL10870262 | 0.76 | HTT (0.38) | HTTKDM4EALDH1A1L3MBTL1CYP2C9 | |
| SCHEMBL26754445 | 0.75 | TYMP (0.34) | KDM4EALDH1A1TSHR | |
| SCHEMBL9879119 | 0.74 | HTT (0.48) | HTTKDM4EALDH1A1L3MBTL1CYP2C9 | |
| SCHEMBL11079720 | 0.73 | POLB (0.56) | HTTKDM4EALDH1A1L3MBTL1CYP2C9 | |
| SCHEMBL9879442 | 0.72 | ALDH1A1 (0.74) | ALDH1A1L3MBTL1CYP2C9CYP2C19NPSR1 |
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-1991018887-A1 | DIAMINOPYRIMIDINE COMPOUNDS | SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) | 1991-12-12 | — | — | WO | disclosed |