Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | FBP1 | P09467 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | CTSA | P10619 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | MGAM | O43451 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | SI | P14410 | 2/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20177203 | 0.72 | KDM4E (0.40) | KDM4ESLC6A3FBP1CYP2D6HRH1 | |
| SCHEMBL8563478 | 0.72 | LMNA (0.39) | KDM4ECYP2D6HRH1KCNH2CTSA | |
| SCHEMBL8564334 | 0.68 | CNR2 (0.36) | KDM4EFBP1CYP2D6HRH1KCNH2 | |
| SCHEMBL6570549 | 0.68 | PDPK1 (0.43) | KDM4ESLC6A3CTSASMN1; SMN2LMNA | |
| SCHEMBL30379415 | 0.67 | SLC6A3 (0.45) | KDM4ESLC6A3FBP1CYP2D6HRH1 | |
| SCHEMBL12549243 | 0.66 | PKM (0.43) | CTSANPC1RAB9AGAASMN1; SMN2 | |
| SCHEMBL20586652 | 0.66 | PLA2G4A (0.44) | KDM4ECTSANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11845503 | 0.65 | CYP1A2 (0.52) | CYP1A2CYP2A6TAAR1NPC1RAB9A | |
| SCHEMBL4705618 | 0.65 | GAA (0.40) | KCNH2CYP1A2CYP2A6TAAR1NPC1 | |
| SCHEMBL1987440 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5670526-A | ANTIINFLAMMATORY AGENT, IMMUNOSUPPRESSANT | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1997-09-23 | — | — | US | disclosed |