Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 9/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL3710210 | 0.87 | ESR1 (0.41) | ESR1TSHRCYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL3711025 | 0.86 | ESR1 (0.39) | ESR1TSHRCYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL3713374 | 0.83 | ESR1 (0.46) | ESR1TSHRCYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL3712970 | 0.81 | ALDH1A1 (0.45) | TSHRLMNAMAPTHPGDMEN1 | |
| SCHEMBL3713822 | 0.81 | TSHR (0.54) | TSHRCYP1A2CYP2C19SMN1; SMN2LMNA | |
| SCHEMBL3714237 | 0.80 | KDM4E (0.43) | TSHRCYP1A2SMN1; SMN2LMNACYP2D6 | |
| SCHEMBL3714487 | 0.80 | KCNH3 (0.40) | TSHRCYP1A2CYP2C19SMN1; SMN2MAPK1 | |
| SCHEMBL3714807 | 0.77 | CA12 (0.46) | TSHRCYP1A2CYP2C19SMN1; SMN2MAPK1 | |
| SCHEMBL3718647 | 0.74 | HDAC3 (0.39) | ESR1MAPK1RAB9AAKR1C4AKR1C3 | |
| SCHEMBL3713958 | 0.73 | L3MBTL1 (0.42) | TSHRCYP1A2CYP2C19LMNACYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010100475-A1 | HYDROXAMIC ACID DERIVATIVES AS GRAM-NEGATIVE ANTIBACTERIAL AGENTS | ASTRAZENECA AB (SE) | 2010-09-10 | — | — | WO | disclosed |
| WO-2010100475-A1 | HYDROXAMIC ACID DERIVATIVES AS GRAM-NEGATIVE ANTIBACTERIAL AGENTS | ASTRAZENECA AB (SE) | 2010-09-10 | — | — | WO | disclosed |