Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.51 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5713020 | 0.86 | ALDH1A1 (0.47) | HTTTSHRTDP1MTNR1AMTNR1B | |
| SCHEMBL28937521 | 0.83 | ALOX5 (0.41) | IRAK4CTNNB1POLBALOX5HTT | |
| SCHEMBL4982136 | 0.81 | CTNNB1 (0.50) | IRAK4CTNNB1POLBPARP10HTT | |
| SCHEMBL4114971 | 0.81 | IRAK4 (0.51) | IRAK4CTNNB1HTTTSHRBCAT2 | |
| SCHEMBL10354800 | 0.80 | IRAK4 (0.55) | IRAK4CTNNB1HTTTSHRTDP1 | |
| SCHEMBL31632660 | 0.78 | IRAK4 (0.55) | IRAK4CTNNB1HTTTSHRBCAT2 | |
| SCHEMBL105262 | 0.78 | IRAK4 (0.55) | IRAK4CTNNB1HTTTSHRBCAT2 | |
| SCHEMBL16508286 | 0.76 | CTNNB1 (0.45) | IRAK4CTNNB1POLBPARP10TSHR | |
| Hydrochloric Acid SCHEMBL28294057 | 0.76 | IRAK4 (0.53) | IRAK4CTNNB1HTTTSHRBCAT2 | |
| Hydrochloric Acid SCHEMBL7849679 | 0.76 | IRAK4 (0.53) | IRAK4CTNNB1HTTTSHRBCAT2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2074103-A1 | 6-PHENYLPYRIMIDINONES AS PIM MODULATORS | Exelixis, Inc. (US) | 2009-07-01 | — | — | EP | disclosed |
| WO-2008133955-A1 | 6-PHENYLPYRIMIDINONES AS PIM MODULATORS | EXELIXIS, INC. (US) | 2008-11-06 | — | — | WO | disclosed |