Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 3/20 | 0.43 |
| ▸ | DRD2 | P14416 | 5/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 4/20 | 0.41 |
| ▸ | DRD5 | P21918 | 3/20 | 0.41 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 2/20 | 0.40 |
| ▸ | DRD3 | P35462 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GMNN | O75496 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL8154453 | 1.00 | MCHR1 (0.49) | MCHR1SIGMAR1KMT2AKDM4ECHRNA7 | |
| SCHEMBL782565 | 1.00 | MCHR1 (0.49) | MCHR1SIGMAR1KMT2AKDM4ECHRNA7 | |
| Fumaric Acid SCHEMBL8146701 | 0.89 | KMT2A (0.43) | MCHR1SIGMAR1KMT2AHTR2ADRD2 | |
| SCHEMBL8147229 | 0.82 | MAPT (0.42) | MCHR1KCNH2CYP2D6 | |
| Hydrochloric Acid SCHEMBL8154808 | 0.82 | SIGMAR1 (0.40) | MCHR1SIGMAR1KMT2AKDM4ECHRNA7 | |
| SCHEMBL8373610 | 0.82 | MCHR1 (0.43) | MCHR1SIGMAR1KMT2AKDM4ECHRNA7 | |
| Hydrochloric Acid SCHEMBL8371422 | 0.82 | SIGMAR1 (0.40) | MCHR1SIGMAR1KMT2AKDM4ECHRNA7 | |
| SCHEMBL8141489 | 0.80 | MCHR1 (0.37) | MCHR1SIGMAR1KMT2AHTR2ADRD2 | |
| SCHEMBL8372824 | 0.79 | MCHR1 (0.38) | MCHR1SIGMAR1KMT2AKDM4EHTR2A | |
| SCHEMBL8373582 | 0.78 | DRD2 (0.49) | SIGMAR1KMT2AHTR2ADRD2HTR2C |
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-6063803-A | ANALGESICS AND CHEMICAL INTERMEDIATES | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2000-05-16 | — | — | US | disclosed |