Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | JAK3 | P52333 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | LTC4S | Q16873 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22453579 | 0.90 | CYP1A2 (0.42) | KDM4CCYP1A2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL22453261 | 0.90 | KDM4C (0.46) | KDM4CNPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL22453259 | 0.80 | KDM4C (0.44) | KDM4CLMNAKDM4ELTC4SKDR | |
| SCHEMBL22453576 | 0.79 | CYP1A2 (0.40) | KDM4CCYP1A2NPC1SMN1; SMN2MAPT | |
| SCHEMBL22453580 | 0.77 | DHODH (0.50) | CYP1A2NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL22453406 | 0.74 | CYP1A2 (0.44) | KDM4CCYP1A2RAB9ASMN1; SMN2MAPT | |
| SCHEMBL22453330 | 0.72 | KDM4C (0.47) | KDM4CCYP1A2SMN1; SMN2MAPTLMNA | |
| SCHEMBL22452936 | 0.71 | NR1H4 (0.35) | CYP1A2SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL22453719 | 0.69 | CYP1A2 (0.37) | KDM4CCYP1A2SMN1; SMN2MAPTGRM5 | |
| SCHEMBL22452931 | 0.66 | S100B (0.46) | KDM4CCYP1A2NPC1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020190774-A1 | NOVEL SMALL MOLECULE INHIBITORS OF TEAD TRANSCRIPTION FACTORS | THE GENERAL HOSPITAL CORPORATION (US) | 2020-09-24 | — | — | WO | disclosed |