Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.38 |
| ▸ | FADS1 | O60427 | 1/20 | 0.38 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1758631 | 0.85 | MEN1 (0.50) | ALDH1A1TP53HDAC1MAPTHPGD | |
| SCHEMBL227131 | 0.73 | TSHR (0.47) | TSHRALDH1A1RAB9AKDM4ENPC1 | |
| SCHEMBL29198073 | 0.71 | CYP2C9 (0.53) | TSHRALDH1A1RAB9AKDM4ENPC1 | |
| SCHEMBL27978437 | 0.71 | MEN1 (0.47) | ALDH1A1TP53MAPTHPGDMEN1 | |
| SCHEMBL30132193 | 0.70 | CA1 (0.50) | TSHRALDH1A1RAB9AKDM4ENPC1 | |
| SCHEMBL325006 | 0.70 | CA1 (0.50) | TSHRALDH1A1RAB9AKDM4ENPC1 | |
| Formic Acid SCHEMBL27489350 | 0.69 | TSHR (0.71) | TSHRALDH1A1KDM4ETP53HDAC1 | |
| SCHEMBL30761074 | 0.69 | TSHR (0.47) | TSHRALDH1A1RAB9AKDM4ENPC1 | |
| SCHEMBL528054 | 0.69 | TSHR (0.47) | TSHRALDH1A1RAB9AKDM4ENPC1 | |
| Nitrogen SCHEMBL29161237 | 0.69 | TSHR (0.88) | TSHRALDH1A1RAB9ANPC1TP53 |
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-6444777-B1 | USING MIXTURE OF POLYISOCYANATE | BASF AKTIENGESELLSCHAFT (DE) | 2002-09-03 | — | — | US | disclosed |