Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | TDP2 | O95551 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | SRD5A2 | P31213 | 4/20 | 0.46 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.46 |
| ▸ | SRD5A1 | P18405 | 3/20 | 0.43 |
| ▸ | NNMT | P40261 | 2/20 | 0.40 |
| ▸ | TTR | P02766 | 1/20 | 0.39 |
| ▸ | PTPRC | P08575 | 2/20 | 0.38 |
| ▸ | CDC7 | O00311 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL10908324 | 0.76 | ACHE (0.51) | ALDH1A1TDP1SRD5A2SRD5A1TTR | |
| SCHEMBL14991559 | 0.76 | TSHR (0.60) | TSHRTDP2MKNK1SRD5A1CDC7 | |
| SCHEMBL3308170 | 0.76 | TSHR (0.60) | TSHRTDP2MKNK1SRD5A1CDC7 | |
| SCHEMBL14991246 | 0.76 | TSHR (0.60) | TSHRTDP2MKNK1SRD5A1CDC7 | |
| SCHEMBL14991244 | 0.76 | TSHR (0.60) | TSHRTDP2MKNK1SRD5A1CDC7 | |
| SCHEMBL2170999 | 0.76 | TSHR (0.60) | TSHRTDP2MKNK1SRD5A1CDC7 | |
| SCHEMBL14332678 | 0.72 | SMYD3 (0.58) | ALDH1A1TDP2SRD5A2SRD5A1TTR | |
| SCHEMBL23294427 | 0.72 | TSHR (0.41) | TSHRTDP2MKNK1CDC7KDM4E | |
| SCHEMBL6448571 | 0.72 | TSHR (1.00) | TSHRTDP2MKNK1MAPT | |
| SCHEMBL12203700 | 0.72 | TSHR (1.00) | TSHRTDP2MKNK1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-115916176-A | Inhibitors of alpha 2 beta 1 integrin and methods of use thereof | 加利福尼亚大学董事会 | 2023-04-04 | — | — | CN | disclosed |