Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | CETP | P11597 | 3/20 | 0.45 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.39 |
| ▸ | PTPRC | P08575 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | SCN1A | P35498 | 3/20 | 0.38 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.38 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16093681 | 0.83 | TSHR (0.63) | TSHRCETPSRCPTPN1PTPRC | |
| SCHEMBL5615776 | 0.78 | TSHR (0.63) | TSHRCETPSRCLMNACYP3A4 | |
| SCHEMBL21446911 | 0.76 | TSHR (0.69) | TSHRCETPSRCLMNAFOLH1 | |
| Alcohol SCHEMBL6037288 | 0.74 | TSHR (0.85) | TSHRCETPSRCFOLH1MTOR | |
| SCHEMBL27908642 | 0.74 | TSHR (1.00) | TSHRCETPSRCLMNAFOLH1 | |
| SCHEMBL51316 | 0.74 | TSHR (1.00) | TSHRCETPSRCLMNAFOLH1 | |
| SCHEMBL1404249 | 0.73 | TSHR (0.81) | TSHRCETPSRCLMNAFOLH1 | |
| SCHEMBL28970082 | 0.73 | CHRM2 (0.65) | TSHRCHRM2CHRM1CHRM3LMNA | |
| SCHEMBL5615806 | 0.73 | TSHR (0.59) | TSHRCETPSRCLMNAFOLH1 | |
| SCHEMBL11756554 | 0.72 | TSHR (0.96) | TSHRCETPSRCLMNAFOLH1 |
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-2007146085-A2 | CREATINE PHOSPHATE PRODRUGS, COMPOSITIONS AND USES THEREOF | XENOPORT, INC. (US) | 2007-12-21 | — | — | WO | disclosed |