Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 1.00 |
| ▸ | RAB9A | P51151 | 2/20 | 1.00 |
| ▸ | POLB | P06746 | 2/20 | 0.65 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | TNKS | O95271 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | BTK | Q06187 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | RNASEH1 | O60930 | 1/20 | 0.45 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8524777 | 0.81 | NPC1 (0.68) | NPC1RAB9APOLBL3MBTL1ALDH1A1 | |
| SCHEMBL8525087 | 0.79 | NPC1 (0.64) | NPC1RAB9APOLBL3MBTL1ALDH1A1 | |
| SCHEMBL7313414 | 0.78 | POLB (1.00) | NPC1RAB9APOLBL3MBTL1ALDH1A1 | |
| SCHEMBL10436160 | 0.78 | NPC1 (0.65) | NPC1RAB9APOLBL3MBTL1ALDH1A1 | |
| SCHEMBL2901740 | 0.78 | NPC1 (0.65) | NPC1RAB9APOLBL3MBTL1ALDH1A1 | |
| SCHEMBL8490907 | 0.78 | NPC1 (0.62) | NPC1RAB9APOLBL3MBTL1ALDH1A1 | |
| SCHEMBL384952 | 0.78 | NPC1 (0.61) | NPC1RAB9APOLBL3MBTL1ALDH1A1 | |
| SCHEMBL11282011 | 0.76 | NPC1 (0.58) | NPC1RAB9APOLBL3MBTL1ALDH1A1 | |
| SCHEMBL24317555 | 0.75 | NPC1 (0.59) | NPC1RAB9APOLBL3MBTL1ALDH1A1 | |
| SCHEMBL836159 | 0.74 | L3MBTL1 (0.63) | NPC1RAB9APOLBL3MBTL1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6071913-A | 2-(1H-TETRAZOL-5-YL)-4'-(AS-TRIAZIN-YLMETHYL)BIPHENYLS; CARDIOVASCULAR DISEASES, ESPECIALLY HYPERTENSION AND CONGESTIVE HEART FAILURE | DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) | 2000-06-06 | — | — | US | disclosed |