Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | FABP3 | P05413 | 1/20 | 0.39 |
| ▸ | FABP4 | P15090 | 1/20 | 0.39 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19872661 | 0.84 | PLA2G2A (0.47) | EGFRHDAC6NPC1RAB9AALDH1A1 | |
| SCHEMBL21392131 | 0.83 | GPR17 (0.48) | EGFRHDAC6NPC1RAB9AALDH1A1 | |
| SCHEMBL21395993 | 0.83 | GPR17 (0.48) | EGFRHDAC6NPC1RAB9AALDH1A1 | |
| SCHEMBL18509969 | 0.83 | EGFR (0.46) | EGFRHDAC6NPC1RAB9AALDH1A1 | |
| SCHEMBL21392040 | 0.81 | PLA2G2A (0.50) | EGFRHDAC6NPC1RAB9AALDH1A1 | |
| SCHEMBL19872668 | 0.81 | EGFR (0.44) | EGFRHDAC6NPC1RAB9AFFAR1 | |
| SCHEMBL18509495 | 0.81 | EGFR (0.47) | EGFRHDAC6NPC1RAB9AALDH1A1 | |
| SCHEMBL18509555 | 0.80 | EGFR (0.43) | EGFRHDAC6NPC1RAB9AALDH1A1 | |
| SCHEMBL18509968 | 0.79 | SLC22A12 (0.42) | EGFRHDAC6NPC1RAB9AALDH1A1 | |
| SCHEMBL21392207 | 0.78 | EGFR (0.46) | EGFRHDAC6NPC1RAB9AFFAR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018081456-A1 | HIGHLY ACTIVE SELF-SUFFICIENT NITRATION BIOCATALYSTS | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) | 2018-05-03 | — | — | WO | disclosed |
| WO-2016134145-A9 | ARTIFICIAL SELF-SUFFICIENT CYTOCHROME P450S | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) | 2017-02-16 | — | — | WO | disclosed |