Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | ALPL | P05186 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.37 |
| ▸ | PRSS2 | P07478 | 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 | |
|---|---|---|---|---|
| SCHEMBL3084322 | 0.94 | ALDH1A1 (0.55) | ALDH1A1TDP1TSHRCYP3A4MCL1 | |
| SCHEMBL29702110 | 0.94 | ALDH1A1 (0.55) | ALDH1A1TDP1TSHRCYP3A4MCL1 | |
| SCHEMBL5390940 | 0.90 | ALDH1A1 (0.52) | ALDH1A1TDP1TSHRCYP3A4MCL1 | |
| Water SCHEMBL9222873 | 0.90 | ALDH1A1 (0.52) | ALDH1A1TDP1TSHRCYP3A4MCL1 | |
| Lithium SCHEMBL30110458 | 0.90 | ALDH1A1 (0.60) | ALDH1A1TDP1TSHRCYP3A4MCL1 | |
| SCHEMBL5396176 | 0.88 | HTR7 (0.52) | ALDH1A1TDP1TSHRCYP3A4MCL1 | |
| SCHEMBL18987225 | 0.86 | ALDH1A1 (0.46) | ALDH1A1TDP1TSHRCYP3A4MCL1 | |
| Methoxymethane SCHEMBL29150576 | 0.85 | ALDH1A1 (0.48) | ALDH1A1TDP1TSHRCYP3A4MCL1 | |
| SCHEMBL1047499 | 0.82 | TDP1 (0.46) | ALDH1A1TDP1TSHRCYP3A4MCL1 | |
| SCHEMBL28597745 | 0.82 | ALDH1A1 (0.52) | ALDH1A1TDP1TSHRCYP3A4MCL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020219411-A1 | POLYMERS FOR USE IN ELECTRONIC DEVICES | DUPONT ELECTRONICS, INC. (US) | 2020-10-29 | — | — | WO | disclosed |
| WO-2020033480-A1 | POLYMERS FOR USE IN ELECTRONIC DEVICES | DUPONT ELECTRONICS, INC. (US) | 2020-02-13 | — | — | WO | disclosed |
| WO-2020033475-A1 | POLYMERS FOR USE IN ELECTRONIC DEVICES | DUPONT ELECTRONICS, INC. (US) | 2020-02-13 | — | — | WO | disclosed |