Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 3/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.46 |
| ▸ | RXRA | P19793 | 2/20 | 0.46 |
| ▸ | RXRB | P28702 | 2/20 | 0.46 |
| ▸ | RXRG | P48443 | 2/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.44 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9780575 | 1.00 | PPARG (0.60) | PPARGKMT2AGAACYP1A2CYP2C9 | |
| SCHEMBL1116784 | 0.85 | PPARG (0.51) | PPARGKMT2AGAACYP1A2CYP2C9 | |
| SCHEMBL11151598 | 0.85 | CYP1A2 (0.55) | PPARGKMT2AGAACYP1A2CYP2C9 | |
| SCHEMBL5696283 | 0.85 | KMT2A (0.62) | PPARGKMT2AGAACYP1A2CYP2C9 | |
| SCHEMBL7934892 | 0.81 | KMT2A (0.50) | PPARGKMT2AADRA2AADRA2BADRA2C | |
| SCHEMBL5861902 | 0.80 | PPARG (0.72) | PPARGAKR1C3AKR1C2RXRARXRB | |
| SCHEMBL10693344 | 0.79 | KMT2A (0.68) | PPARGKMT2AGAACYP1A2CYP2C9 | |
| SCHEMBL105728 | 0.78 | ADRA2A (0.53) | PPARGADRA2AADRA2BADRA2CRXRA | |
| SCHEMBL4955094 | 0.78 | PPARG (0.50) | PPARGGAAAKR1C3AKR1C2ADRA2A | |
| SCHEMBL9780966 | 0.77 | GAA (0.66) | PPARGKMT2AGAACYP1A2CYP2C9 |
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-5010060-A | Method of treating herpes simplex viral infection employing pyrimidine derivatives | HOFFMANN-LA ROCHE INC. (US) | 1991-04-23 | — | — | US | disclosed |
| US-4851519-A | AMIDO NUCLEOSIDES, VIRICIDES | HOFFMANN-LA ROCHE INC. (US) | 1989-07-25 | — | — | US | disclosed |