Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | TGM2 | P21980 | 2/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.33 |
| ▸ | ACE | P12821 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL8950538 | 0.85 | SMN1; SMN2 (0.44) | HSD17B10SLC6A9TSHRTGM2S1PR1 | |
| SCHEMBL8950554 | 0.85 | SMN1; SMN2 (0.44) | HSD17B10SLC6A9TSHRTGM2S1PR1 | |
| SCHEMBL8950521 | 0.84 | SMN1; SMN2 (0.39) | HSD17B10SLC6A9TSHRTGM2S1PR1 | |
| SCHEMBL8950614 | 0.82 | SMN1; SMN2 (0.43) | HSD17B10SLC6A9TSHRSMN1; SMN2KMT2A | |
| SCHEMBL8950473 | 0.82 | SMN1; SMN2 (0.43) | HSD17B10SLC6A9TSHRSMN1; SMN2KMT2A | |
| SCHEMBL5590521 | 0.79 | HSD17B10 (0.37) | HSD17B10SLC6A9TSHRTGM2S1PR1 | |
| SCHEMBL166595 | 0.78 | SMN1; SMN2 (0.52) | HSD17B10TSHRSMN1; SMN2ALDH1A1KMT2A | |
| SCHEMBL8950488 | 0.78 | HSD17B10 (0.36) | HSD17B10SLC6A9TSHRTGM2S1PR1 | |
| Tetraxetan SCHEMBL1894580 | 0.78 | CRBN (0.46) | HSD17B10SLC6A9TSHRTGM2S1PR1 | |
| SCHEMBL173508 | 0.78 | HSD17B10 (0.64) | HSD17B10SLC6A9TSHRS1PR1SMN1; SMN2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5556968-A | Polyazamacrocycle chelating agents with amide linkages | NYCOMED SALUTAR, INC. (US) | 1996-09-17 | — | — | US | claimed |
| EP-0556240-B1 | CHELATING AGENTS | NYCOMED SALUTAR INC (US) | 1996-07-10 | — | — | EP | claimed |
| EP-0556240-A1 | CHELATING AGENTS. | COCKBAIN JULIAN R M (GB) | 1993-08-25 | — | — | EP | claimed |
| WO-1992008707-A1 | CHELATING AGENTS | COCKBAIN, JULIAN, RODERICK, MICHAELSON (GB) | 1992-05-29 | — | — | WO | claimed |
| US-5556968-A | Polyazamacrocycle chelating agents with amide linkages | NYCOMED SALUTAR, INC. (US) | 1996-09-17 | — | — | US | disclosed |