Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | P2RY1 | P47900 | 8/20 | 0.52 |
| ▸ | P2RY2 | P41231 | 3/20 | 0.52 |
| ▸ | P2RY11 | Q96G91 | 3/20 | 0.52 |
| ▸ | SRC | P12931 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | DNPH1 | O43598 | 1/20 | 0.52 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.52 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.52 |
| ▸ | LDHA | P00338 | 1/20 | 0.52 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.52 |
| ▸ | FBP1 | P09467 | 1/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.52 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.52 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.52 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.52 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.52 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL31005215 | 0.93 | P2RY1 (0.56) | P2RY1P2RY2SRCSMN1; SMN2TRPM2 | |
| SCHEMBL14636151 | 0.91 | TKT (0.56) | TDP1P2RY1P2RY2P2RY11SRC | |
| SCHEMBL675658 | 0.90 | LMNA (0.58) | TDP1P2RY1P2RY2P2RY11SRC | |
| Adenosine SCHEMBL2702312 | 0.88 | LMNA (0.56) | TDP1P2RY1P2RY2SRCSMN1; SMN2 | |
| Cocarboxylase SCHEMBL14636148 | 0.86 | LMNA (0.63) | TDP1P2RY1P2RY2SRCSMN1; SMN2 | |
| Adenosine SCHEMBL675657 | 0.86 | LMNA (0.62) | TDP1P2RY1P2RY2SRCSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7793647 | 0.85 | TDP1 (0.55) | TDP1LMNATKTRNASEL | |
| Adenosine SCHEMBL6862749 | 0.84 | HSP90AA1 (0.53) | TDP1P2RY1P2RY2P2RY11SRC | |
| Adenosine SCHEMBL15347371 | 0.83 | HSP90AA1 (0.57) | SMN1; SMN2ADORA1 | |
| Adenosine Triphosphate SCHEMBL28087656 | 0.80 | P2RY1 (0.56) | P2RY1P2RY2SRCSMN1; SMN2TRPM2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1410302-A2 | CLASSIFICATION OF POLYPEPTIDES BY LIGAND GEOMETRY AND RELATED METHODS | Triad Therapeutics, Inc. (US) | 2004-04-21 | — | — | EP | claimed |
| US-20030236630-A1 | Classification of polypeptides by ligand geometry and related methods | TRIAD THERAPEUTICS, INC. | 2003-12-25 | — | — | US | claimed |
| US-20020133296-A1 | Classification of polypeptides by ligand geometry and related methods | TRIAD THERAPEUTICS, INC. | 2002-09-19 | — | — | US | claimed |
| WO-2002056236-A2 | CLASSIFICATION OF POLYPEPTIDES BY LIGAND GEOMETRY AND RELATED METHODS | TRIAD THERAPEUTICS INC (US) | 2002-07-18 | — | — | WO | claimed |