Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK9 | P50750 | 3/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.40 |
| ▸ | DYRK2 | Q92630 | 2/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | TLR8 | Q9NR97 | 6/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 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 | |
|---|---|---|---|---|
| SCHEMBL11804036 | 0.96 | TLR8 (0.38) | CDK9DYRK1ADYRK2CNR1CNR2 | |
| SCHEMBL11517572 | 0.87 | KDM4E (0.40) | CDK9DYRK1ADYRK2TSHRCYP1A2 | |
| SCHEMBL11812486 | 0.86 | KMT2A (0.33) | CDK9DYRK1ADYRK2MEN1PKM | |
| SCHEMBL11812652 | 0.81 | CHRNB2 (0.36) | CDK9DYRK1ADYRK2TSHRKDM4E | |
| SCHEMBL11869897 | 0.81 | ALDH1A1 (0.38) | CDK9DYRK1ACNR1CNR2CYP1A2 | |
| SCHEMBL11806977 | 0.80 | HSD11B1 (0.34) | CDK9DYRK1AKDM4EALDH1A1HPGD | |
| SCHEMBL11810909 | 0.79 | GRM2 (0.35) | DYRK1ACNR1CNR2 | |
| SCHEMBL11812366 | 0.78 | ADRB2 (0.30) | ADRB2 | |
| SCHEMBL11857528 | 0.78 | ALDH1A1 (0.38) | CYP1A2ALDH1A1MEN1KMT2A | |
| SCHEMBL11804027 | 0.77 | DHFR (0.32) | — |
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-3954438-A | 5-Trifluoromethyl-7-aminobenzimidazoles herbicides | UNITED STATES BORAX & CHEMICAL CORPORATION (US) | 1976-05-04 | — | — | US | disclosed |