Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.53 |
| ▸ | TDP2 | O95551 | 2/20 | 0.43 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.43 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | KDM4A | O75164 | 1/20 | 0.41 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | BID | P55957 | 3/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.40 |
| ▸ | BAK1 | Q16611 | 2/20 | 0.40 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.40 |
| ▸ | PPARG | P37231 | 2/20 | 0.40 |
| ▸ | EP300 | Q09472 | 1/20 | 0.40 |
| ▸ | KAT2A | Q92830 | 1/20 | 0.40 |
| ▸ | KAT2B | Q92831 | 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 | |
|---|---|---|---|---|
| SCHEMBL28472394 | 0.85 | BRD4 (0.61) | BRD4TDP2PDE4ALMNAKDM4E | |
| SCHEMBL14895437 | 0.84 | BRD4 (0.58) | BRD4TDP2PDE4ALMNAKDM4E | |
| SCHEMBL5498415 | 0.82 | KDM4E (0.58) | PPARAKDM4ECYP1A2BIDMCL1 | |
| SCHEMBL18598998 | 0.82 | BID (0.44) | PPARAKDM4ECYP1A2BIDMCL1 | |
| SCHEMBL10932980 | 0.82 | BID (0.44) | PPARAKDM4ECYP1A2BIDMCL1 | |
| SCHEMBL18132204 | 0.82 | BRD4 (0.58) | BRD4TDP2CYP4F2CYP4A11PDE4A | |
| SCHEMBL24908480 | 0.81 | KDM4E (0.57) | PPARAKDM4ECYP1A2BIDMCL1 | |
| SCHEMBL3369457 | 0.81 | BRD4 (0.57) | BRD4TDP2PDE4AKDM4ECYP1A2 | |
| SCHEMBL9094733 | 0.81 | KDM4E (0.57) | PPARAKDM4ECYP1A2BIDMCL1 | |
| SCHEMBL7908951 | 0.81 | BRD4 (0.57) | BRD4TDP2PDE4AKDM4ECYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109053742-A | New tricyclic compound | ABBVIE 公司 | 2018-12-21 | — | — | CN | disclosed |
| CN-106046106-A | C-3 cycloalkenyl triterpenoids with HIV maturation inhibitory activity | 百时美施贵宝公司 | 2016-10-26 | — | — | CN | disclosed |
| CN-104220451-B | C-3 cycloalkene triterpenoids with HIV maturation inhibitory activity | 百时美施贵宝公司 | 2016-06-29 | — | — | CN | disclosed |