Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 3/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.34 |
| ▸ | BAD | Q92934 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | PTPRC | P08575 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL20573134 | 1.00 | TSHR (0.35) | TSHRHTTMAOBPKMAOC3 | |
| SCHEMBL2187434 | 0.92 | BAD (0.35) | TSHRHTTMAOBPKMAOC3 | |
| SCHEMBL16735526 | 0.92 | BAD (0.35) | TSHRHTTMAOBPKMAOC3 | |
| SCHEMBL2187428 | 0.92 | BAD (0.35) | TSHRHTTMAOBPKMAOC3 | |
| SCHEMBL2211320 | 0.86 | PKM (0.41) | TSHRMAOBPKMBADTDP1 | |
| SCHEMBL2209666 | 0.78 | ALDH1A1 (0.35) | TSHRPKMAOC3BADALDH1A1 | |
| SCHEMBL2209664 | 0.78 | ALDH1A1 (0.35) | TSHRPKMAOC3BADALDH1A1 | |
| SCHEMBL2215277 | 0.78 | KMT2A (0.37) | TSHRMAOBPKMAOC3BAD | |
| SCHEMBL2215273 | 0.78 | KMT2A (0.37) | TSHRMAOBPKMAOC3BAD | |
| SCHEMBL2206321 | 0.78 | ALDH1A1 (0.38) | HTTPKMBADALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3131539-B1 | SEMICARBAZIDE-SENSITIVE AMINE OXIDASE INHIBITORS FOR USE AS ANALGESICS IN TRAUMATIC NEUROPATHY AND NEUROGENIC INFLAMMATION | PECSI TUDOMANYEGYETEM (HU) | 2018-12-05 | — | — | EP | claimed |