Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.88 |
| ▸ | BLM | P54132 | 2/20 | 0.88 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.88 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.54 |
| ▸ | TUBB | P07437 | 2/20 | 0.54 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.54 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.54 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.54 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.54 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.54 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.54 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.54 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.54 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.54 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.54 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.54 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.54 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL134326 | 0.94 | TSHR (1.00) | TSHRBLMNPSR1CYP3A4NFKB1 | |
| SCHEMBL1243722 | 0.94 | TSHR (1.00) | TSHRBLMNPSR1CYP3A4NFKB1 | |
| SCHEMBL10085823 | 0.94 | TSHR (1.00) | TSHRBLMNPSR1CYP3A4NFKB1 | |
| SCHEMBL140947 | 0.94 | TSHR (1.00) | TSHRBLMNPSR1CYP3A4NFKB1 | |
| SCHEMBL352960 | 0.94 | NPSR1 (0.76) | TSHRBLMNPSR1TUBB4ATUBB | |
| SCHEMBL10085812 | 0.94 | NPSR1 (0.76) | TSHRBLMNPSR1TUBB4ATUBB | |
| SCHEMBL503700 | 0.94 | NPSR1 (0.76) | TSHRBLMNPSR1TUBB4ATUBB | |
| SCHEMBL20566321 | 0.92 | BLM (0.91) | TSHRBLMNPSR1CYP3A4NFKB1 | |
| SCHEMBL10784788 | 0.92 | TSHR (0.97) | TSHRBLMNPSR1CYP3A4NFKB1 | |
| SCHEMBL28717780 | 0.92 | TSHR (0.97) | TSHRBLMNPSR1CYP3A4NFKB1 |
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-5561157-A | INCLUDES ORGANIC ALPHA AND BETA HYDROXY OR KETO CARBOXYLIC ACIDS, ESTERS, LACTONES AND/OR SALTS; USED FOR SKIN DISORDERS | TRISTRATA INC (US) | 1996-10-01 | — | — | US | claimed |