Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 3/20 | 0.38 |
| ▸ | DRD4 | P21917 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | HTR7 | P34969 | 3/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3374256 | 0.68 | CXCR3 (0.42) | DRD2DRD4MEN1KMT2APOLB | |
| SCHEMBL23939174 | 0.65 | CYP2A13 (0.58) | MEN1KMT2AKDM4EMAPTALDH1A1 | |
| SCHEMBL3372885 | 0.63 | KDM4E (0.37) | DRD2DRD4MEN1KMT2APOLB | |
| SCHEMBL15614461 | 0.63 | MC4R (0.53) | DRD4KMT2APOLBKDM4EALDH1A1 | |
| SCHEMBL14380993 | 0.62 | ALDH1A1 (0.53) | MEN1KMT2APOLBKDM4EALDH1A1 | |
| SCHEMBL31448683 | 0.62 | CYP2A13 (0.69) | MEN1KMT2APOLBKDM4EALDH1A1 | |
| SCHEMBL4111089 | 0.62 | CYP2A13 (0.63) | MEN1KMT2AKDM4EMAPTALDH1A1 | |
| SCHEMBL13594974 | 0.61 | ALDH1A1 (0.56) | MEN1KMT2APOLBKDM4ENPSR1 | |
| SCHEMBL4711132 | 0.60 | KMT2A (0.62) | MEN1KMT2AKDM4ENPSR1MAPT | |
| SCHEMBL31653411 | 0.59 | HTT (0.56) | DRD2DRD4POLBKDM4EMAPT |
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-2010045006-A1 | METHYLENE AMINES OF THIENO [2,3-D] PYRIMIDINE AND THEIR USE AS ADENOSINE A2A RECEPTOR ANTAGONISTS | JANSSEN PHARMACEUTICA NV (BE) | 2010-04-22 | — | — | WO | disclosed |