Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | F2 | P00734 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.46 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28987549 | 0.80 | LMNA (0.50) | TSHRLMNAF2TP53PDCD1 | |
| SCHEMBL4072679 | 0.77 | TSHR (0.58) | TSHRLMNAF2TP53ALDH1A1 | |
| SCHEMBL9679649 | 0.76 | LMNA (0.61) | TSHRLMNAF2TP53ALDH1A1 | |
| SCHEMBL5835571 | 0.76 | LMNA (0.61) | TSHRLMNAF2TP53ALDH1A1 | |
| SCHEMBL28202295 | 0.75 | TSHR (0.56) | TSHRLMNAF2TP53ALDH1A1 | |
| SCHEMBL10239104 | 0.72 | TSHR (0.63) | TSHRLMNAF2TP53PDCD1 | |
| SCHEMBL6660758 | 0.72 | TSHR (0.63) | TSHRLMNAF2TP53PDCD1 | |
| SCHEMBL29311500 | 0.72 | TSHR (0.63) | TSHRLMNAF2TP53PDCD1 | |
| SCHEMBL13700339 | 0.72 | TSHR (0.63) | TSHRLMNAF2TP53PDCD1 | |
| SCHEMBL13625602 | 0.72 | TSHR (0.63) | TSHRLMNAF2TP53PDCD1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109476616-A | Piperazinyl methanone NAAA inhibitor | 加利福尼亚大学董事会 | 2019-03-15 | — | — | CN | disclosed |
| CN-104892462-B | New noncrystalline methacrylate, its preparation and application | 科思创德国股份有限公司 | 2017-08-22 | — | — | CN | disclosed |
| CN-103261170-B | Fused heterocyclic compounds and their use for pest control | 住友化学株式会社 | 2016-08-24 | — | — | CN | disclosed |
| CN-102666469-B | Novel noncrystalline methacrylates, their preparation and use | BAYER MATERIALSCIENCE AG (DE) | 2016-03-02 | — | — | CN | disclosed |
| CN-104892462-A | Novel noncrystalline methacrylates, their preparation and use | BAYER MATERIALSCIENCE AG | 2015-09-09 | — | — | CN | disclosed |