Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.38 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.38 |
| ▸ | FNTA | P49354 | 1/20 | 0.38 |
| ▸ | FNTB | P49356 | 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 | |
|---|---|---|---|---|
| SCHEMBL23188915 | 0.79 | TSHR (0.45) | TSHRPOLBTAAR1CNR2NPC1 | |
| SCHEMBL20344668 | 0.73 | CES2 (0.39) | TSHRCNR2CES2CES1AKR1B1 | |
| SCHEMBL21896514 | 0.70 | CES2 (0.42) | TSHRTAAR1CES2CES1AKR1B1 | |
| SCHEMBL4746745 | 0.69 | ALDH1A1 (0.58) | TSHRTAAR1MEN1KMT2ACYP1A2 | |
| SCHEMBL4743831 | 0.69 | ALDH1A1 (0.58) | TSHRTAAR1MEN1KMT2ACYP1A2 | |
| SCHEMBL21156347 | 0.69 | ALDH1A1 (0.46) | TSHRMEN1KMT2ANPC1RAB9A | |
| SCHEMBL18755879 | 0.68 | CES2 (0.39) | POLBTAAR1CNR2CES2CES1 | |
| SCHEMBL5842514 | 0.68 | POLB (0.59) | POLBCNR2MEN1KMT2AHDAC8 | |
| SCHEMBL22710318 | 0.68 | CES1 (0.40) | TSHRCNR2CES2CES1AKR1B1 | |
| SCHEMBL4664544 | 0.67 | TSHR (0.49) | TSHRPOLBCNR2CES2CES1 |
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-3508484-A1 | HETEROCYCLIC AMIDES AS KINASE INHIBITORS | GlaxoSmithKline Intellectual Property Development Limited (GB) | 2019-07-10 | — | — | EP | disclosed |