Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 5/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | GRM6 | O15303 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL5837759 | 0.91 | ADORA1 (0.36) | ALDH1A1TSHRKDM4EKMT2AGRM6 | |
| SCHEMBL5838365 | 0.90 | CYP1A2 (0.40) | ALDH1A1KDM4ESMN1; SMN2KMT2AGRM6 | |
| SCHEMBL5838589 | 0.86 | CXCR2 (0.37) | ALDH1A1TSHRSMN1; SMN2L3MBTL1HCRTR1 | |
| SCHEMBL5837601 | 0.84 | MEN1 (0.35) | ALDH1A1KMT2AGRM6ADORA1 | |
| SCHEMBL5838682 | 0.84 | HPGD (0.33) | ALDH1A1TSHRKDM4EKMT2AGRM6 | |
| SCHEMBL6316462 | 0.83 | ADORA1 (0.35) | ALDH1A1TSHRKDM4ESMN1; SMN2GRM6 | |
| SCHEMBL5838574 | 0.82 | ALDH1A1 (0.41) | ALDH1A1TSHRKDM4EPOLBACHE | |
| SCHEMBL5837768 | 0.82 | ALDH1A1 (0.45) | ALDH1A1TSHRPOLBKMT2A | |
| SCHEMBL5838657 | 0.81 | ALDH1A1 (0.37) | ALDH1A1L3MBTL1POLBCA1CA2 | |
| SCHEMBL5838142 | 0.81 | ADORA1 (0.38) | ALDH1A1TSHRKDM4ESMN1; SMN2KMT2A |
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-7115624-B1 | Method of inhibiting protein tyrosine phosphatase 1B and/or T-cell protein tyrosine phosphatase 4 and/or other PTPases with an Asp residue at position 48 | NOVO NORDISK A/S (DK) | 2006-10-03 | — | — | US | disclosed |
| US-7019026-B1 | Modulators of Protein Tyrosine Phosphatases (PTPases) | NOVO NORDISK A/S (DK) | 2006-03-28 | — | — | US | disclosed |
| EP-1214325-B1 | MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) | NOVO NORDISK AS (DK) | 2005-11-09 | — | — | EP | disclosed |
| EP-1214325-A1 | MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) | NOVO NORDISK A/S (DK) | 2002-06-19 | — | — | EP | disclosed |
| WO-2001019831-A1 | MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) | NOVO NORDISK A/S (DK) | 2001-03-22 | — | — | WO | disclosed |