Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | MVD | P53602 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Triethyl Phosphate SCHEMBL10800671 | 0.82 | TSHR (0.62) | TSHRMEN1POLBGAAKMT2A | |
| SCHEMBL27771235 | 0.77 | TSHR (0.62) | TSHRALDH1A1ACHETP53TDP1 | |
| SCHEMBL13301622 | 0.77 | MVD (0.38) | TSHRGAAALDH1A1ACHEMVD | |
| SCHEMBL28234432 | 0.77 | TPI1 (0.46) | ALDH1A1MVDSMN1; SMN2 | |
| Triethyl Phosphate SCHEMBL10358522 | 0.76 | TSHR (0.77) | TSHRALDH1A1TP53TDP1PPARD | |
| SCHEMBL28065638 | 0.76 | TSHR (0.59) | TSHRTP53TDP1PPARDCA1 | |
| SCHEMBL28308540 | 0.76 | TSHR (0.59) | TSHRALDH1A1ACHETP53TDP1 | |
| Triethyl Phosphate SCHEMBL1332591 | 0.75 | TSHR (1.00) | TSHRMEN1POLBGAAKMT2A | |
| Triethyl Phosphate SCHEMBL28023664 | 0.75 | TSHR (1.00) | TSHRMEN1POLBGAAKMT2A | |
| Triethyl Phosphate SCHEMBL27822049 | 0.75 | TSHR (1.00) | TSHRMEN1POLBGAAKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-105636923-A | Process and intermediates for preparing macrolide amides | MERCK SHARP & DOHME | 2016-06-01 | — | — | CN | disclosed |
| CN-1231212-C | Polycyclic compounds that inhibit VLA-4 mediated leukocyte adhesion | ELAN PHARM INC (US) | 2005-12-14 | — | — | CN | disclosed |