Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.69 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.69 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.69 |
| ▸ | MEN1 | O00255 | 1/20 | 0.69 |
| ▸ | TP53 | P04637 | 1/20 | 0.69 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.69 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.69 |
| ▸ | TSHR | P16473 | 1/20 | 0.69 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.64 |
| ▸ | HTT | P42858 | 2/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.62 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9539965 | 0.86 | ALDH1A1 (0.72) | KMT2AADRB2ADRB1MEN1TP53 | |
| SCHEMBL9540272 | 0.86 | KMT2A (0.77) | KMT2AADRB2ADRB1MEN1TP53 | |
| SCHEMBL9537979 | 0.86 | KMT2A (0.64) | KMT2AADRB2ADRB1MEN1TP53 | |
| SCHEMBL5715164 | 0.85 | ADRB2 (0.66) | KMT2AADRB2ADRB1MEN1TP53 | |
| Hydrochloric Acid SCHEMBL9589964 | 0.85 | ALDH1A1 (0.71) | KMT2AADRB2ADRB1MEN1TP53 | |
| SCHEMBL9537333 | 0.83 | KMT2A (0.77) | KMT2AADRB2ADRB1MEN1TP53 | |
| Hydrochloric Acid SCHEMBL9588039 | 0.83 | KMT2A (0.76) | KMT2AADRB2ADRB1MEN1TP53 | |
| SCHEMBL9538697 | 0.82 | ALDH1A1 (0.74) | KMT2AADRB2ADRB1MEN1TP53 | |
| SCHEMBL3692842 | 0.82 | KMT2A (1.00) | KMT2AADRB2ADRB1MEN1TP53 | |
| SCHEMBL20608337 | 0.82 | KMT2A (1.00) | KMT2AADRB2ADRB1MEN1TP53 |
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 |
|---|---|---|---|---|---|---|---|
| US-7291624-B2 | CDK-inhibitory pyrimidines, their production and use as pharmaceutical agents | BAYER SCHERING PHARMA AG (DE) | 2007-11-06 | — | — | US | disclosed |
| US-7235561-B2 | Compound and a composition including such a compound | SCHERING AG (DE) | 2007-06-26 | — | — | US | disclosed |