Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.38 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.38 |
| ▸ | HEXA | P06865 | 1/20 | 0.36 |
| ▸ | HEXB | P07686 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21385864 | 0.74 | ACHE (0.61) | TDP1ACHEHPGDLMNAHEXA | |
| SCHEMBL13454735 | 0.71 | NR1H2 (0.38) | TDP1ACHENOTUMPOLBHPGD | |
| SCHEMBL4147252 | 0.70 | ACHE (0.50) | TDP1ACHEHPGDHEXAHEXB | |
| SCHEMBL12367284 | 0.69 | ENPP3 (0.45) | TDP1ACHENOTUMPOLBHPGD | |
| SCHEMBL4155727 | 0.69 | ACHE (0.48) | TDP1ACHEHPGDHEXAHEXB | |
| SCHEMBL13664879 | 0.69 | ENPP3 (0.45) | TDP1ACHENOTUMPOLBHPGD | |
| SCHEMBL3287696 | 0.67 | ACHE (0.73) | TDP1ACHEHPGDLMNAENPP3 | |
| SCHEMBL18661495 | 0.67 | ACHE (0.73) | TDP1ACHEHPGDLMNAENPP3 | |
| SCHEMBL197731 | 0.67 | ACHE (0.73) | TDP1ACHEHPGDLMNAENPP3 | |
| SCHEMBL4164181 | 0.67 | ACHE (0.40) | TDP1ACHENOTUMNPC1RAB9A |
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-2017019964-A1 | GRAPHITIC COMPOUNDS AND METHODS OF MAKING AND USE THEREOF | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2017-02-02 | — | — | WO | disclosed |