Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | CRHBP | P24387 | 1/20 | 0.51 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 4/20 | 0.43 |
| ▸ | KIF11 | P52732 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MET | P08581 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.39 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | CDK9 | P50750 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19322278 | 0.91 | NR4A2 (0.50) | KDM4EKMT2AGAANPC1RAB9A | |
| SCHEMBL28024552 | 0.90 | KIF11 (0.49) | KDM4ECRHBPCRHR2KMT2AGAA | |
| SCHEMBL28207430 | 0.86 | KDM4E (0.53) | KDM4ECRHBPCRHR2KMT2AGAA | |
| SCHEMBL28024557 | 0.84 | NR4A2 (0.49) | KDM4EKMT2AGAANPC1RAB9A | |
| SCHEMBL28025008 | 0.83 | ALOX5 (0.56) | KDM4EKMT2AGAANPC1RAB9A | |
| SCHEMBL28025005 | 0.82 | RAB9A (0.52) | KDM4EKMT2ANPC1RAB9AKIF11 | |
| SCHEMBL28206980 | 0.82 | RAB9A (0.52) | KDM4EKMT2ANPC1RAB9AKIF11 | |
| SCHEMBL28024558 | 0.81 | NR4A2 (0.48) | KDM4EKMT2AGAANPC1RAB9A | |
| SCHEMBL19322108 | 0.80 | ALDH1A1 (0.49) | KDM4EKMT2AGAANPC1RAB9A | |
| SCHEMBL28024553 | 0.80 | KDM4E (0.54) | KDM4EKMT2AGAANPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-105646327-A | 2-perfluoroalkyl indole derivative and synthesis method thereof | 上海大学 | 2016-06-08 | — | — | CN | disclosed |
| CN-104892485-A | 2-perfluoroalkyl indole derivative and synthesis method thereof | UNIV SHANGHAI | 2015-09-09 | — | — | CN | disclosed |