Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | TYR | P14679 | 1/20 | 0.51 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 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 | |
|---|---|---|---|---|
| Butylated Hydroxytoluene SCHEMBL8644225 | 0.87 | CA2 (0.50) | ALDH1A1SMN1; SMN2CA2POLBTYR | |
| Butylated Hydroxytoluene SCHEMBL1426526 | 0.82 | SMN1; SMN2 (0.50) | ALDH1A1SMN1; SMN2CA2POLBTYR | |
| SCHEMBL62285 | 0.81 | HPGD (0.50) | ALDH1A1TYRCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL30945822 | 0.81 | HPGD (0.50) | ALDH1A1TYRCYP2C9CYP2C19HSD17B10 | |
| Butylated Hydroxytoluene SCHEMBL28288111 | 0.79 | CA2 (0.75) | ALDH1A1SMN1; SMN2CA2POLBTYR | |
| SCHEMBL38662058 | 0.79 | HTT (0.48) | ALDH1A1TYRHIF1AHSD17B10HPGD | |
| Hexane SCHEMBL27304683 | 0.79 | HTT (0.48) | ALDH1A1TYRHIF1AHSD17B10HPGD | |
| Butylated Hydroxytoluene SCHEMBL8080322 | 0.79 | TYR (0.50) | ALDH1A1SMN1; SMN2CA2POLBTYR | |
| SCHEMBL984201 | 0.78 | TYR (0.49) | ALDH1A1TYRHIF1AHSD17B10HPGD | |
| SCHEMBL984727 | 0.78 | HPGD (0.47) | ALDH1A1TYRCYP2C9CYP2C19HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-12043741-B2 | Conjugated diene-based polymer composition and tire | ASAHI KASEI KABUSHIKI KAISHA (JP) | 2024-07-23 | — | — | US | disclosed |
| US-20210284827-A1 | CONJUGATED DIENE-BASED POLYMER COMPOSITION AND TIRE | ASAHI KASEI KABUSHIKI KAISHA (JP) | 2021-09-16 | — | — | US | disclosed |