Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.34 |
| ▸ | TSHR | P16473 | 4/20 | 0.34 |
| ▸ | NR1D1 | P20393 | 1/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | RXRA | P19793 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11227704 | 0.85 | ALDH1A1 (0.38) | ALDH1A1TDP1TSHRCYP3A4SMN1; SMN2 | |
| SCHEMBL11235046 | 0.81 | GRIN2D (0.37) | TSHRHTTMAPTPOLB | |
| SCHEMBL3025962 | 0.79 | DAO (0.45) | ALDH1A1TDP1TSHRSMN1; SMN2MAPT | |
| SCHEMBL11233516 | 0.77 | NPC1 (0.32) | ALDH1A1SMN1; SMN2NPC1JAK2HTT | |
| SCHEMBL11221886 | 0.77 | SNCA (0.44) | ALDH1A1TDP1TSHRHTTNPSR1 | |
| SCHEMBL7764208 | 0.75 | ALDH1A1 (0.39) | ALDH1A1TDP1TSHRCYP3A4HTT | |
| SCHEMBL27926184 | 0.75 | NR1H4 (0.46) | ALDH1A1TDP1TSHRCYP3A4HTT | |
| SCHEMBL4233822 | 0.75 | TSHR (0.58) | ALDH1A1TDP1TSHRMAPTMEN1 | |
| SCHEMBL701265 | 0.74 | HSD17B10 (0.48) | ALDH1A1TDP1TSHRCYP3A4SMN1; SMN2 | |
| SCHEMBL9322428 | 0.73 | LOXL2 (0.42) | ALDH1A1TSHRPOLB |
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-4341898-A | DEHYDROGENATION-ISOMERIZATION REACTION IN PRESENCE OF LEWIS ACID | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1982-07-27 | — | — | US | disclosed |