Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | STIM1 | Q13586 | 1/20 | 0.46 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.45 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.45 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL16708689 | 0.81 | POLB (0.45) | LMNARECQLKMT2AALDH1A1HPGD | |
| SCHEMBL10960527 | 0.79 | LMNA (0.52) | LMNAMAPK1RECQLKMT2AALDH1A1 | |
| SCHEMBL28469826 | 0.77 | KMO (0.44) | SMO | |
| SCHEMBL11563936 | 0.76 | LMNA (0.49) | LMNAMAPK1RECQLKMT2AALDH1A1 | |
| SCHEMBL15391223 | 0.76 | CA12 (0.45) | GPBAR1RECQLKMT2AALDH1A1HPGD | |
| SCHEMBL8842839 | 0.74 | PHGDH (0.53) | LMNAMAPK1RECQLKMT2AALDH1A1 | |
| SCHEMBL462903 | 0.72 | HSD11B1 (0.45) | LMNAKMT2AALDH1A1HPGDKDM4E | |
| SCHEMBL29272612 | 0.72 | SMN1; SMN2 (0.40) | GPBAR1LMNAMAPK1KMT2AALDH1A1 | |
| SCHEMBL3365574 | 0.72 | BRD4 (0.47) | LMNAMAPK1RECQLKMT2AALDH1A1 | |
| SCHEMBL23294557 | 0.71 | HAO1 (0.56) | LMNARECQLKMT2AALDH1A1HPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104540810-A | Methanethione compounds having antiviral activity | VIRONOVA AB | 2015-04-22 | — | — | CN | disclosed |