Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | GRM5 | P41594 | 2/20 | 0.46 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.46 |
| ▸ | MMP13 | P45452 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.45 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NAMPT | P43490 | 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 | |
|---|---|---|---|---|
| SCHEMBL16598141 | 0.83 | HTT (0.62) | SMN1; SMN2GRM5HTTHPGDHDAC8 | |
| SCHEMBL13728272 | 0.82 | PRMT6 (0.50) | P2RX7SMN1; SMN2MMP13HTTCYP2C9 | |
| SCHEMBL27965276 | 0.80 | MMP13 (0.69) | P2RX7SMN1; SMN2MMP13HTTCYP1A2 | |
| SCHEMBL13728048 | 0.76 | MMP13 (0.77) | P2RX7SMN1; SMN2MMP13HTTHPGD | |
| SCHEMBL6464062 | 0.75 | P2RX7 (0.42) | P2RX7SMN1; SMN2KDM4CNPSR1KMT2A | |
| SCHEMBL13728282 | 0.75 | ROCK2 (0.55) | P2RX7SMN1; SMN2MMP13HTTCYP2C9 | |
| SCHEMBL8350587 | 0.74 | MMP13 (0.59) | MMP13CYP1A2CYP2C9HPGDCYP2C19 | |
| SCHEMBL6216641 | 0.74 | RAB9A (0.68) | P2RX7SMN1; SMN2HTTCYP1A2CYP2C9 | |
| SCHEMBL13727215 | 0.74 | SORT1 (0.55) | P2RX7SMN1; SMN2MMP13CYP1A2CYP2C9 | |
| SCHEMBL13729131 | 0.73 | MMP13 (0.52) | P2RX7SMN1; SMN2MMP13HTTCYP1A2 |
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-1441734-A1 | DIHYDROXYPYRIMIDINE CARBOXAMIDE INHIBITORS OF HIV INTEGRASE | Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) | 2004-08-04 | — | — | EP | disclosed |
| WO-2003035076-A1 | DIHYDROXYPYRIMIDINE CARBOXAMIDE INHIBITORS OF HIV INTEGRASE | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) | 2003-05-01 | — | — | WO | disclosed |