Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | YARS1 | P54577 | 1/20 | 0.40 |
| ▸ | TOP1 | P11387 | 2/20 | 0.38 |
| ▸ | FOLH1 | Q04609 | 7/20 | 0.36 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.33 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10817270 | 0.92 | TSHR (0.48) | TSHRRAB9AKDM4EALDH1A1GAA | |
| SCHEMBL11274306 | 0.89 | TSHR (0.45) | TSHRRAB9AKDM4EALDH1A1GAA | |
| SCHEMBL11279778 | 0.87 | TSHR (0.47) | TSHRRAB9AKDM4EALDH1A1GAA | |
| SCHEMBL10817518 | 0.81 | YARS1 (0.44) | TSHRKDM4EGAAYARS1FOLH1 | |
| SCHEMBL10813720 | 0.80 | YARS1 (0.41) | TSHRKDM4EGAAYARS1TDP1 | |
| SCHEMBL11269448 | 0.80 | YARS1 (0.46) | TSHRKDM4EGAAYARS1FOLH1 | |
| SCHEMBL11271511 | 0.79 | CA1 (0.43) | TSHRRAB9AKDM4EALDH1A1GAA | |
| SCHEMBL11456692 | 0.76 | TOP1 (0.46) | TSHRRAB9AKDM4EALDH1A1GAA | |
| SCHEMBL11458211 | 0.76 | TSHR (0.44) | TSHRRAB9AKDM4EALDH1A1GAA | |
| SCHEMBL10437840 | 0.70 | TOP1 (0.59) | TSHRRAB9AKDM4EALDH1A1GAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0093564-B1 | BETA-LACTAM ANTIBIOTICS | BEECHAM GROUP PLC (GB) | 1987-06-24 | — | — | EP | disclosed |
| US-4540688-A | β-Lactam antibiotics | BEECHAM GROUP P.L.C. (GB) | 1985-09-10 | — | — | US | disclosed |
| EP-0093564-A1 | Beta-lactam antibiotics | BEECHAM GROUP PLC (GB) | 1983-11-09 | — | — | EP | disclosed |