Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.38 |
| ▸ | LPO | P22079 | 2/20 | 0.38 |
| ▸ | P2RX4 | Q99571 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27719798 | 0.83 | BCHE (0.43) | BCHESMN1; SMN2TSHRALDH1A1NPSR1 | |
| SCHEMBL20568595 | 0.73 | BCHE (0.40) | BCHEMEN1KMT2AHTTGABRA1 | |
| SCHEMBL7209262 | 0.71 | KMT2A (0.47) | BCHEMEN1KMT2AHTTGABRA1 | |
| SCHEMBL20568280 | 0.71 | LPO (0.36) | LPO | |
| SCHEMBL1127344 | 0.70 | MEN1 (0.42) | BCHEMEN1KMT2AHTTLPO | |
| SCHEMBL14002933 | 0.68 | LPO (0.48) | BCHEMEN1KMT2ALPOP2RX4 | |
| SCHEMBL30711215 | 0.67 | NOTUM (0.65) | BCHEMEN1KMT2ASMN1; SMN2TSHR | |
| SCHEMBL1173678 | 0.67 | NOTUM (0.65) | BCHEMEN1KMT2ASMN1; SMN2TSHR | |
| SCHEMBL30109124 | 0.67 | NOTUM (0.39) | BCHEMEN1KMT2ALPOMAPT | |
| SCHEMBL25905087 | 0.66 | FLT1 (0.39) | BCHEMEN1KMT2ALPOP2RX4 |
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 |