Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR3 | P49682 | 5/20 | 0.42 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3377154 | 0.86 | CYP2A13 (0.58) | CYP2A13ALDH1A1HTTRAB9ASMN1; SMN2 | |
| SCHEMBL3372885 | 0.72 | KDM4E (0.37) | HTTRAB9ASMN1; SMN2MEN1KMT2A | |
| SCHEMBL3344984 | 0.72 | NPC1 (0.49) | CYP2A13ALDH1A1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL3374752 | 0.68 | DRD2 (0.38) | ALDH1A1HTTSMN1; SMN2MEN1KMT2A | |
| SCHEMBL9335409 | 0.66 | CNR2 (0.47) | ALDH1A1HTTRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL3149917 | 0.66 | CXCR3 (0.65) | CXCR3 | |
| SCHEMBL8116232 | 0.65 | CYP2A13 (0.62) | CYP2A13CCR5SIGMAR1ALDH1A1MEN1 | |
| SCHEMBL6947104 | 0.65 | CYP2A13 (0.62) | CYP2A13CCR5SIGMAR1ALDH1A1MEN1 | |
| SCHEMBL1111744 | 0.65 | LTA4H (0.51) | ALDH1A1HTTRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL15525055 | 0.65 | LTA4H (0.41) | CXCR3HTTRAB9AMEN1KMT2A |
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 |