Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28647269 | 0.80 | KDM4E (0.50) | LMNAALDH1A1GAACYP1A2KDM4E | |
| SCHEMBL5415657 | 0.75 | F2RL3 (0.54) | LMNAALDH1A1GAACYP1A2KDM4E | |
| SCHEMBL29750688 | 0.75 | BRD4 (0.46) | ALDH1A1CYP1A2KDM4EMEN1KMT2A | |
| SCHEMBL31193308 | 0.73 | GABRA2 (0.56) | ALDH1A1GAACYP1A2KDM4EMEN1 | |
| SCHEMBL20568973 | 0.71 | LMNA (0.45) | LMNAALDH1A1GAACYP1A2KDM4E | |
| SCHEMBL20570148 | 0.71 | LMNA (0.50) | LMNAALDH1A1GAACYP1A2KDM4E | |
| SCHEMBL31193387 | 0.70 | GABRA2 (0.53) | LMNAALDH1A1GAACYP1A2KDM4E | |
| SCHEMBL1126744 | 0.70 | ALDH1A1 (0.45) | LMNAALDH1A1GAACYP1A2KDM4E | |
| SCHEMBL27870399 | 0.69 | ALDH1A1 (0.47) | LMNAALDH1A1GAACYP1A2KDM4E | |
| SCHEMBL6480433 | 0.68 | MAPT (0.48) | LMNAALDH1A1GAAKDM4EMEN1 |
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-3630728-A1 | INHIBITORS OF METALLO-BETA-LACTAMASES | Oxford University Innovation Limited (GB) | 2020-04-08 | — | — | EP | disclosed |
| WO-2018215799-A1 | INHIBITORS OF METALLO-BETA-LACTAMASES | OXFORD UNIVERSITY INNOVATION LIMITED (GB) | 2018-11-29 | — | — | WO | disclosed |