Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM5A | P29375 | 6/20 | 0.56 |
| ▸ | KDM4C | Q9H3R0 | 4/20 | 0.56 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.56 |
| ▸ | KDM5C | P41229 | 1/20 | 0.56 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.56 |
| ▸ | PHF8 | Q9UPP1 | 3/20 | 0.54 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.54 |
| ▸ | PPARG | P37231 | 7/20 | 0.54 |
| ▸ | PPARD | Q03181 | 7/20 | 0.54 |
| ▸ | PPARA | Q07869 | 7/20 | 0.54 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.54 |
| ▸ | TSHR | P16473 | 4/20 | 0.54 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | TLR2 | O60603 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | FABP4 | P15090 | 2/20 | 0.54 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.54 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL3290191 | 0.89 | GPR84 (0.61) | KDM5AKDM4CAKR1B1PHF8GPR84 | |
| SCHEMBL10974021 | 0.86 | ALDH1A1 (0.46) | KDM5AKDM4CAKR1B1KDM5CKDM5B | |
| SCHEMBL3806653 | 0.86 | ALDH1A1 (0.46) | KDM5AKDM4CAKR1B1KDM5CKDM5B | |
| Stearic Acid SCHEMBL28175504 | 0.83 | GPR84 (0.63) | AKR1B1GPR84PPARGPPARDPPARA | |
| Acetic Acid SCHEMBL28134864 | 0.83 | GPR84 (0.47) | KDM5AKDM4CAKR1B1PHF8GPR84 | |
| SCHEMBL8068893 | 0.80 | AKR1B1 (0.60) | KDM5AKDM4CAKR1B1KDM5CKDM5B | |
| SCHEMBL19782857 | 0.79 | ALDH1A1 (0.48) | AKR1B1GPR84PPARGPPARDPPARA | |
| SCHEMBL27306760 | 0.79 | ALDH1A1 (0.54) | KDM5AKDM4CPHF8ALDH1A1 | |
| SCHEMBL8065184 | 0.78 | GPR84 (0.61) | KDM5AKDM4CAKR1B1KDM5CKDM5B | |
| SCHEMBL2808717 | 0.78 | GPR84 (0.61) | KDM5AKDM4CAKR1B1KDM5CKDM5B |
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 |
|---|---|---|---|---|---|---|---|
| EP-1255748-A1 | BETA-ALANINE DERIVATIVES AND THEIR USE AS RECEPTOR ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-11-13 | — | — | EP | disclosed |
| WO-2001060813-A1 | BETA-ALANINE DERIVATIVES AND THEIR USE AS RECEPTOR ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-08-23 | — | — | WO | disclosed |