Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 6/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 4/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KLK1 | P06870 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA4 | P22748 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA6 | P23280 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11451272 | 0.91 | TSHR (0.39) | ALOX15ALOX12AKR1B1TSHRCYP3A4 | |
| SCHEMBL10781181 | 0.86 | AKR1B1 (0.41) | ALOX15ALOX12AKR1B1TSHRKLK1 | |
| SCHEMBL28049518 | 0.81 | TSHR (0.36) | ALOX15ALOX12AKR1B1TSHRCYP3A4 | |
| SCHEMBL11640450 | 0.80 | CA1 (0.32) | CA2CA4CA1CA6 | |
| SCHEMBL94118 | 0.75 | KLK1 (0.45) | ALOX15ALOX12TSHRCYP3A4TDP1 | |
| SCHEMBL11693977 | 0.75 | ALOX15 (0.38) | ALOX15ALOX12AKR1B1TSHRCYP3A4 | |
| SCHEMBL9240974 | 0.73 | KLK1 (0.53) | TSHRCYP3A4TDP1KLK1THRB | |
| SCHEMBL9241719 | 0.73 | KLK1 (0.48) | TSHRCYP3A4TDP1KLK1MAPT | |
| SCHEMBL11690258 | 0.73 | TSHR (0.36) | ALOX15ALOX12AKR1B1TSHR | |
| SCHEMBL1045003 | 0.71 | TSHR (0.36) | ALOX15ALOX12AKR1B1TSHRCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-3985831-A | RUBBERY POLY-CONJUGATED DIENE AND BIS-(HALOARYLOXY)ALKANE | BORG-WARNER CORPORATION (US) | 1976-10-12 | — | — | US | disclosed |