Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | STAT3 | P40763 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | UTS2R | Q9UKP6 | 5/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.37 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.36 |
| ▸ | LYN | P07948 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL904101 | 0.94 | KDM4E (0.41) | KDM4EALDH1A1STAT3UTS2RHTT | |
| SCHEMBL904096 | 0.90 | NPC1 (0.40) | KDM4EALDH1A1NPC1RAB9AUTS2R | |
| SCHEMBL1006695 | 0.90 | GPR119 (0.47) | KDM4EALDH1A1STAT3NPC1RAB9A | |
| SCHEMBL10067573 | 0.81 | KDM4E (0.42) | KDM4ENPC1RAB9AGPR119 | |
| SCHEMBL1006128 | 0.80 | GPR119 (0.47) | KDM4ENPC1RAB9AGPR119 | |
| SCHEMBL1004810 | 0.79 | GPR119 (0.48) | KDM4ENPC1RAB9AGPR119 | |
| SCHEMBL1008624 | 0.79 | GPR119 (0.47) | KDM4ENPC1RAB9AUTS2RGPR119 | |
| SCHEMBL1006217 | 0.79 | GPR119 (0.47) | KDM4EALDH1A1NPC1RAB9AGPR119 | |
| SCHEMBL13660399 | 0.77 | UTS2R (0.43) | UTS2RHTTGPR119 | |
| SCHEMBL1005645 | 0.77 | GPR119 (0.45) | KDM4ENPC1RAB9AGPR119 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012041158-A1 | TRICYCLIC COMPOUND, PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF | 上海恒瑞医药有限公司 (CN) | 2012-04-05 | — | — | WO | disclosed |