Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 1/20 | 0.46 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.46 |
| ▸ | BCHE | P06276 | 6/20 | 0.45 |
| ▸ | KDM1A | O60341 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.43 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.43 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.43 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28353177 | 0.99 | F2 (0.46) | F2PRSS1HRH3BCHEKDM1A | |
| SCHEMBL27700669 | 0.84 | BCHE (0.55) | F2PRSS1BCHEHDAC2HDAC1 | |
| SCHEMBL27810920 | 0.82 | BCHE (0.61) | F2PRSS1BCHEHDAC2HDAC1 | |
| SCHEMBL28352751 | 0.80 | KMT2A (0.49) | F2PRSS1BCHEKCNA3OPRL1 | |
| SCHEMBL27709635 | 0.77 | BCHE (0.59) | F2PRSS1BCHEHDAC2HDAC1 | |
| SCHEMBL27742584 | 0.77 | F2 (0.63) | F2PRSS1BCHEHDAC2HDAC1 | |
| SCHEMBL27652150 | 0.77 | HDAC3 (0.60) | F2PRSS1BCHEHDAC2HDAC1 | |
| SCHEMBL28356285 | 0.76 | TSHR (0.60) | KDM1AMAOAMAOB | |
| SCHEMBL28356284 | 0.76 | TSHR (0.60) | KDM1AMAOAMAOB | |
| SCHEMBL27630590 | 0.76 | HDAC3 (0.62) | F2PRSS1BCHEHDAC2HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110770224-B | Indole derivatives as efflux pump inhibitors | 罗格斯新泽西州立大学 | 2022-11-18 | — | — | CN | disclosed |
| CN-110770224-A | Indole derivatives as efflux pump inhibitors | 罗格斯新泽西州立大学 | 2020-02-07 | — | — | CN | disclosed |