Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
| ▸ | EPOR | P19235 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | EYA2 | O00167 | 1/20 | 0.32 |
| ▸ | APP | P05067 | 1/20 | 0.32 |
| ▸ | ACE | P12821 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.32 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.32 |
| ▸ | PTGER2 | P43116 | 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 | |
|---|---|---|---|---|
| SCHEMBL847204 | 0.95 | TDP1 (0.44) | TDP1ALOX15TSHRCYP2C19HIF1A | |
| SCHEMBL10984905 | 0.89 | ALOX15 (0.38) | TDP1ALOX15TSHRCYP2C19HIF1A | |
| SCHEMBL10985506 | 0.88 | ALOX15 (0.36) | TDP1ALOX15TSHRCYP2C19HIF1A | |
| SCHEMBL17075274 | 0.84 | TSHR (0.40) | TDP1ALOX15TSHRCYP2C19HIF1A | |
| SCHEMBL10984383 | 0.80 | SMN1; SMN2 (0.38) | ALOX15TSHRCYP2C19HIF1AALDH1A1 | |
| SCHEMBL10984140 | 0.79 | ALOX15 (0.35) | TDP1ALOX15TSHRCYP2C19HIF1A | |
| SCHEMBL18493237 | 0.78 | ALDH1A1 (0.44) | TDP1TSHRCYP2C19PTPN1ALDH1A1 | |
| SCHEMBL641321 | 0.78 | TDP1 (0.49) | TDP1ALOX15TSHRCYP2C19HIF1A | |
| SCHEMBL10984773 | 0.76 | — | — | |
| SCHEMBL997695 | 0.75 | TSHR (0.46) | TDP1TSHRCYP2C19ALDH1A1 |
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-4543216-A | REACTING A VINYL BENZYL HALIDE WITH AN AMINO ACID OR AMINO SULFONIC ACID | NIPPON PAINT CO., LTD. (JP) | 1985-09-24 | — | — | US | disclosed |
| US-4452746-A | TO MODIFY PROPERTIES OF HIGH MOLECULAR WEIGHT COMPOUNDS | NIPPON PAINT CO., LTD. (JP) | 1984-06-05 | — | — | US | disclosed |