Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 3/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.35 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.35 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28144559 | 0.81 | TSHR (0.47) | TSHRKDM4ECYP2C9HIF1AALDH1A1 | |
| SCHEMBL28144595 | 0.81 | TSHR (0.47) | TSHRKDM4ECYP2C9HIF1AALDH1A1 | |
| SCHEMBL27994450 | 0.81 | TSHR (0.47) | TSHRKDM4ECYP2C9HIF1AALDH1A1 | |
| SCHEMBL27994717 | 0.81 | TSHR (0.47) | TSHRKDM4ECYP2C9HIF1AAR | |
| SCHEMBL28047411 | 0.79 | CYP2C9 (0.53) | TSHRKDM4ECYP2C9HIF1AALDH1A1 | |
| SCHEMBL8889938 | 0.75 | TSHR (0.51) | TSHRCYP2C9HIF1AALDH1A1POLB | |
| SCHEMBL28110730 | 0.75 | GABRA1 (0.50) | TSHRKDM4ECYP2C9HIF1AALDH1A1 | |
| SCHEMBL28050988 | 0.74 | TSHR (0.48) | TSHRKDM4ECYP2C9HIF1AALDH1A1 | |
| SCHEMBL28857243 | 0.73 | TSHR (0.47) | TSHRKDM4ECYP2C9HIF1AALDH1A1 | |
| SCHEMBL16316852 | 0.73 | TSHR (0.61) | TSHRKDM4ECYP2C9HIF1AALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104884442-B | Terazololine-one compound and application thereof | 住友化学株式会社 | 2016-11-02 | — | — | CN | disclosed |
| CN-104884442-A | Tetrazolinone compound and applications thereof | SUMITOMO CHEMICAL CO | 2015-09-02 | — | — | CN | disclosed |