Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 4/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | DGKA | P23743 | 1/20 | 0.46 |
| ▸ | ABL1 | P00519 | 2/20 | 0.45 |
| ▸ | RIN1 | Q13671 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | PAM | P19021 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13554107 | 0.98 | CYP1A2 (0.52) | CYP1A2TSHRTDP1ALDH1A1ALOX15 | |
| SCHEMBL15065552 | 0.90 | TSHR (0.57) | CYP1A2TSHRTDP1ALDH1A1ALOX15 | |
| SCHEMBL849161 | 0.89 | DGKA (0.50) | CYP1A2TSHRTDP1ALDH1A1ALOX15 | |
| SCHEMBL10502694 | 0.89 | DGKA (0.60) | CYP1A2TSHRALDH1A1HSD17B10DGKA | |
| SCHEMBL17822803 | 0.87 | TDP1 (0.53) | CYP1A2TSHRTDP1ALDH1A1ALOX15 | |
| SCHEMBL9109410 | 0.86 | CYP1A2 (0.59) | CYP1A2TSHRTDP1ALDH1A1ALOX15 | |
| SCHEMBL17275129 | 0.86 | CYP1A2 (0.67) | CYP1A2TSHRTDP1ALDH1A1ALOX15 | |
| SCHEMBL10504555 | 0.85 | DGKA (0.55) | CYP1A2TSHRALDH1A1HSD17B10DGKA | |
| SCHEMBL7747709 | 0.85 | DGKA (0.55) | CYP1A2TSHRALDH1A1HSD17B10DGKA | |
| SCHEMBL9007897 | 0.84 | DGKA (0.46) | CYP1A2TSHRTDP1ALDH1A1ALOX15 |
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-5571689-A | Method of N-acylating peptide and proteins with diheteroatom substituted analogs of myristic acid | WASHINGTON UNIVERSITY (US) | 1996-11-05 | — | — | US | disclosed |
| EP-0441765-B1 | Novel fatty acid analog enzyme substrates | UNIV WASHINGTON (US) | 1994-05-11 | — | — | EP | disclosed |
| US-5082967-A | Myristolyation | WASHINGTON UNIVERSITY (US) | 1992-01-21 | — | — | US | disclosed |
| EP-0441765-A1 | Novel fatty acid analog enzyme substrates | WASHINGTON UNIVERSITY (US) | 1991-08-14 | — | — | EP | disclosed |