Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CLPP | Q16740 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | SCD | O00767 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 4/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4153055 | 0.84 | GRM2 (0.51) | KCNH2GRM2MEN1KMT2ALMNA | |
| SCHEMBL4153402 | 0.80 | KCNH2 (0.45) | KCNH2GRM2MEN1KMT2ACLPP | |
| SCHEMBL4144321 | 0.80 | GRM2 (0.45) | KCNH2GRM2MEN1KMT2ALMNA | |
| SCHEMBL14260043 | 0.80 | KCNH2 (0.47) | KCNH2GRM2MEN1KMT2ALMNA | |
| SCHEMBL4161826 | 0.78 | KCNH2 (0.45) | KCNH2GRM2MEN1KMT2ACLPP | |
| SCHEMBL4153120 | 0.78 | GRM2 (0.43) | KCNH2GRM2MEN1KMT2ALMNA | |
| SCHEMBL4156706 | 0.78 | KCNH2 (0.43) | KCNH2GRM2MEN1KMT2ACLPP | |
| SCHEMBL4153119 | 0.77 | KCNH2 (0.42) | KCNH2GRM2MEN1KMT2ACLPP | |
| SCHEMBL4140673 | 0.77 | GAA (0.44) | KCNH2GRM2MEN1KMT2ALMNA | |
| SCHEMBL2898139 | 0.75 | KCNH2 (0.45) | KCNH2GRM2MEN1KMT2ALMNA |
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-1725554-A1 | HIV INTEGRASE INHIBITORS | Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) | 2006-11-29 | — | — | EP | disclosed |
| WO-2005087766-A1 | HIV INTEGRASE INHIBITORS | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) | 2005-09-22 | — | — | WO | disclosed |