Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACKR3 | P25106 | 5/20 | 0.65 |
| ▸ | LMNA | P02545 | 3/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.56 |
| ▸ | EPAS1 | Q99814 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | KDM1A | O60341 | 1/20 | 0.54 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 4/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.53 |
| ▸ | TP53 | P04637 | 3/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.51 |
| ▸ | AURKA | O14965 | 1/20 | 0.51 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.50 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.50 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5254353 | 0.89 | ACKR3 (0.72) | ACKR3SIRT2SIRT1SIRT3 | |
| SCHEMBL17270151 | 0.79 | ACKR3 (1.00) | ACKR3 | |
| SCHEMBL30577399 | 0.78 | SMN1; SMN2 (0.63) | ACKR3LMNAHIF1AEPAS1ALDH1A1 | |
| SCHEMBL17754101 | 0.78 | SMN1; SMN2 (0.63) | ACKR3LMNAHIF1AEPAS1ALDH1A1 | |
| SCHEMBL24538336 | 0.76 | ABL1 (0.66) | ACKR3LMNAHIF1AEPAS1ALDH1A1 | |
| SCHEMBL28153587 | 0.76 | PLK4 (0.56) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL6672309 | 0.76 | KDM4E (0.59) | ACKR3LMNAHIF1AEPAS1ALDH1A1 | |
| SCHEMBL3113084 | 0.75 | P2RX7 (0.51) | ALDH1A1SMN1; SMN2KCNH2 | |
| SCHEMBL1265244 | 0.75 | TEK (0.68) | LMNAAURKARPS6KB1 | |
| SCHEMBL10464721 | 0.75 | SMN1; SMN2 (0.54) | ACKR3LMNAHIF1AEPAS1ALDH1A1 |
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 |