Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TAS2R14 | Q9NYV8 | 11/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.41 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.41 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.41 |
| ▸ | CXCR3 | P49682 | 2/20 | 0.39 |
| ▸ | PTGES | O14684 | 1/20 | 0.39 |
| ▸ | TAS2R8 | Q9NYW2 | 1/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
| ▸ | NAPRT | Q6XQN6 | 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 | |
|---|---|---|---|---|
| SCHEMBL9134432 | 1.00 | ALDH1A1 (0.50) | ALDH1A1KDM4ETDP1TSHRHSD17B10 | |
| SCHEMBL9134431 | 0.94 | ALDH1A1 (0.45) | ALDH1A1KDM4ETDP1TSHRHSD17B10 | |
| SCHEMBL9136239 | 0.90 | ALDH1A1 (0.49) | ALDH1A1KDM4ETDP1TSHRHSD17B10 | |
| Terephthalic Acid SCHEMBL8092882 | 0.87 | ALDH1A1 (0.65) | ALDH1A1KDM4ETDP1TSHRHSD17B10 | |
| Terephthalic Acid SCHEMBL8434829 | 0.87 | ALDH1A1 (0.65) | ALDH1A1KDM4ETDP1TSHRHSD17B10 | |
| SCHEMBL9134310 | 0.85 | TSHR (0.41) | ALDH1A1TSHRHSD17B10TAS2R14MEN1 | |
| SCHEMBL9134330 | 0.85 | TSHR (0.41) | ALDH1A1TSHRHSD17B10TAS2R14MEN1 | |
| Benzoic Acid SCHEMBL592072 | 0.84 | ALDH1A1 (0.65) | ALDH1A1KDM4ETDP1TSHRHSD17B10 | |
| Terephthalic Acid SCHEMBL8434830 | 0.83 | ALDH1A1 (0.55) | ALDH1A1KDM4ETDP1TSHRHSD17B10 | |
| Tetramethylammonium Ion SCHEMBL9137931 | 0.82 | TSHR (0.50) | ALDH1A1TDP1TSHRSRD5A2DAO |
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 |
|---|---|---|---|---|---|---|---|
| US-5378571-A | Toners for electrography | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-01-03 | — | — | US | disclosed |
| US-5274184-A | Aryl sulphide, aryl sulphoxide and aryl sulphone compounds | CASSELLA AKTIENGESELLSCHAFT (DE) | 1993-12-28 | — | — | US | disclosed |