Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.35 |
| ▸ | CDC42 | P60953 | 1/20 | 0.35 |
| ▸ | RAC1 | P63000 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28690276 | 0.83 | CA12 (0.47) | ADRA2AADRA1ACYP2D6MEN1MAPK1 | |
| SCHEMBL6825547 | 0.80 | ADRA2A (0.42) | ADRA2AADRA1AGAACYP2D6MEN1 | |
| SCHEMBL12248178 | 0.78 | ADRA2A (0.46) | ADRA2AADRA1AGAACYP2D6MEN1 | |
| SCHEMBL31003156 | 0.78 | ADRA2A (0.46) | ADRA2AADRA1AGAACYP2D6MEN1 | |
| SCHEMBL8067912 | 0.78 | TDP1 (0.40) | ADRA1AMEN1KMT2AMAPTCYP1A2 | |
| SCHEMBL12248154 | 0.74 | ADRA2A (0.47) | ADRA2AADRA1AGAACYP2D6HTT | |
| SCHEMBL21670853 | 0.74 | SCN1A (0.41) | ADRA2AADRA1AGAACYP2D6MEN1 | |
| SCHEMBL848282 | 0.74 | KDM4E (0.49) | GAACYP2D6MEN1KMT2AHTT | |
| SCHEMBL9081255 | 0.73 | ADRA2A (0.44) | ADRA2AADRA1ACYP2D6MAPK1HTT | |
| SCHEMBL10318373 | 0.72 | HTT (0.46) | BLMHTTPTGS2PTGS1AKR1C3 |
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 |
|---|---|---|---|---|---|---|---|
| US-7851637-B2 | Compounds and methods for inhibiting the interaction of BCL proteins with binding partners | INFINITY PHARMACEUTICALS, INC. (US) | 2010-12-14 | — | — | US | disclosed |
| US-7851637-B2 | Compounds and methods for inhibiting the interaction of BCL proteins with binding partners | INFINITY PHARMACEUTICALS, INC. (US) | 2010-12-14 | — | — | US | disclosed |