Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.59 |
| ▸ | DAO | P14920 | 1/20 | 0.59 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.59 |
| ▸ | SRD5A2 | P31213 | 5/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | CES2 | O00748 | 1/20 | 0.56 |
| ▸ | CES1 | P23141 | 1/20 | 0.56 |
| ▸ | RARB | P10826 | 1/20 | 0.52 |
| ▸ | RARG | P13631 | 1/20 | 0.52 |
| ▸ | RXRA | P19793 | 2/20 | 0.52 |
| ▸ | RXRB | P28702 | 2/20 | 0.52 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.50 |
| ▸ | KIF11 | P52732 | 1/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.48 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA3 | P07451 | 1/20 | 0.48 |
| ▸ | TYR | P14679 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL18896444 | 1.00 | TSHR (0.59) | TSHRDAONAPRTSRD5A2TP53 | |
| SCHEMBL2176223 | 0.93 | TSHR (0.67) | TSHRDAONAPRTSRD5A2TP53 | |
| SCHEMBL23861614 | 0.92 | CA12 (0.64) | TSHRDAONAPRTSRD5A2TP53 | |
| SCHEMBL6351953 | 0.88 | SRD5A2 (0.65) | TSHRDAONAPRTSRD5A2RXRA | |
| SCHEMBL16772180 | 0.86 | RXRA (0.62) | TSHRSRD5A2TP53RARBRARG | |
| SCHEMBL407595 | 0.84 | TSHR (0.56) | TSHRDAONAPRTSRD5A2TP53 | |
| SCHEMBL5311010 | 0.84 | TSHR (0.56) | TSHRDAONAPRTSRD5A2TP53 | |
| SCHEMBL27683133 | 0.84 | ALDH1A1 (0.57) | SRD5A2RXRARXRBEPHX2NR1H4 | |
| SCHEMBL23861613 | 0.82 | TSHR (0.45) | TSHRDAONAPRTSRD5A2TP53 | |
| SCHEMBL13956160 | 0.82 | KCNN4 (0.61) | TSHRDAONAPRTSRD5A2TP53 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10787576-B2 | Method for the preparation of a coating comprising oligomeric alkynes | ÉCOLE POLYTECHNIQUE FÉDÉRALE DE LAUSANNE (EPFL) EPFL-TTO (CH) | 2020-09-29 | — | — | US | disclosed |
| US-20190048202-A1 | METHOD FOR THE PREPARATION OF A COATING COMPRISING OLIGOMERIC ALKYNES | ÉCOLE POLYTECHNIQUE FÉDÉRALE DE LAUSANNE (EPFL) EPFL-TTO (CH) | 2019-02-14 | — | — | US | disclosed |
| CN-105051048-B | 1-hydroxy-benzoxaboroles as antiparasitic agents | 伊莱利利公司 | 2017-03-15 | — | — | CN | disclosed |
| CN-105051048-A | 1-hydroxy-benzoxaboroles as antiparasitic agents | LILLY CO ELI | 2015-11-11 | — | — | CN | disclosed |