Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.64 |
| ▸ | TSHR | P16473 | 7/20 | 0.59 |
| ▸ | HPGD | P15428 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | CA1 | P00915 | 1/20 | 0.57 |
| ▸ | CA2 | P00918 | 1/20 | 0.57 |
| ▸ | CA9 | Q16790 | 1/20 | 0.57 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | PDE4A | P27815 | 1/20 | 0.50 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.50 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.50 |
| ▸ | PDE4D | Q08499 | 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 | |
|---|---|---|---|---|
| SCHEMBL3456212 | 0.85 | TSHR (0.77) | ALDH1A1TSHRHPGDLMNASMN1; SMN2 | |
| SCHEMBL7831372 | 0.81 | NOTUM (0.62) | ALDH1A1TSHRLMNASMN1; SMN2POLB | |
| SCHEMBL7344622 | 0.80 | AVPR1A (0.61) | TSHRSMN1; SMN2 | |
| SCHEMBL11853725 | 0.80 | ESR1 (0.69) | ALDH1A1TSHRHPGDLMNACA1 | |
| SCHEMBL16585793 | 0.80 | PDK1 (0.58) | ALDH1A1TSHRHPGDLMNASMN1; SMN2 | |
| SCHEMBL16494288 | 0.80 | RAB9A (0.71) | ALDH1A1TSHRHPGDLMNASMN1; SMN2 | |
| SCHEMBL11158732 | 0.79 | CA1 (0.69) | ALDH1A1TSHRHPGDSMN1; SMN2RAB9A | |
| SCHEMBL30488348 | 0.79 | HSD17B10 (0.53) | ALDH1A1TSHRLMNACA1CA2 | |
| SCHEMBL28771923 | 0.78 | RAB9A (0.65) | ALDH1A1TSHRHPGDSMN1; SMN2RAB9A | |
| SCHEMBL11849653 | 0.78 | ESR1 (0.72) | ALDH1A1TSHRHPGDLMNASMN1; SMN2 |
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-3997542-A | 1-(Halogenated-acetyl)-1,2,3,4-tetrahydro-6-quinolinols and esters thereof | STERLING DRUG INC. (US) | 1976-12-14 | — | — | US | disclosed |