Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | HPGD | P15428 | 5/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.57 |
| ▸ | MYC | P01106 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.50 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.50 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.50 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL27265959 | 0.97 | TSHR (0.61) | TSHRALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL756585 | 0.97 | TSHR (0.61) | TSHRALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL27703149 | 0.97 | TSHR (0.61) | TSHRALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL27552497 | 0.95 | TSHR (0.59) | TSHRALDH1A1HPGDKDM4EHSD17B10 | |
| Bicarbonate SCHEMBL27492485 | 0.95 | TSHR (0.59) | TSHRALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL27479457 | 0.95 | TSHR (0.59) | TSHRALDH1A1HPGDKDM4EHSD17B10 | |
| Water SCHEMBL27479836 | 0.95 | TSHR (0.59) | TSHRALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL10768142 | 0.95 | TSHR (0.59) | TSHRALDH1A1HPGDKDM4EHSD17B10 | |
| Ethane SCHEMBL27288094 | 0.95 | TSHR (0.59) | TSHRALDH1A1HPGDKDM4EHSD17B10 | |
| Ammonia Solution, Strong SCHEMBL27776892 | 0.95 | TSHR (0.59) | TSHRALDH1A1HPGDKDM4EHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1055179-A | Novel 8-sulphonamide methylene radical-2-amino-1,2,3,4-tetralin | MERRELL DOW PHARMA (US) | 1991-10-09 | — | — | CN | disclosed |