Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 6/20 | 0.64 |
| ▸ | MAOA | P21397 | 3/20 | 0.64 |
| ▸ | MAOB | P27338 | 3/20 | 0.64 |
| ▸ | HTR2C | P28335 | 1/20 | 0.55 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.49 |
| ▸ | TUBB | P07437 | 1/20 | 0.49 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.49 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.49 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.49 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.49 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.49 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.49 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.49 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.49 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.49 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.49 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.49 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.49 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11064726 | 0.84 | KDM1A (0.72) | KDM1AMAOAMAOBHTR2CTUBB4A | |
| SCHEMBL11064728 | 0.84 | KDM1A (0.72) | KDM1AMAOAMAOBHTR2CTUBB4A | |
| SCHEMBL12875739 | 0.80 | KDM1A (0.67) | KDM1AMAOAMAOBHTR2CTUBB4A | |
| SCHEMBL31450919 | 0.80 | KDM1A (0.67) | KDM1AMAOAMAOBHTR2CTUBB4A | |
| SCHEMBL16155721 | 0.80 | KDM1A (0.67) | KDM1AMAOAMAOBHTR2CTUBB4A | |
| SCHEMBL6755876 | 0.78 | KDM1A (1.00) | KDM1AMAOAMAOBHTR2CSLC6A3 | |
| SCHEMBL18596475 | 0.78 | KDM1A (1.00) | KDM1AMAOAMAOBHTR2CSLC6A3 | |
| SCHEMBL5729043 | 0.78 | KDM1A (1.00) | KDM1AMAOAMAOBHTR2CSLC6A3 | |
| SCHEMBL7094099 | 0.78 | KDM1A (1.00) | KDM1AMAOAMAOBHTR2CSLC6A3 | |
| Ammonia Solution, Strong SCHEMBL265654 | 0.78 | KDM1A (0.64) | KDM1AMAOAMAOBHTR2CTUBB4A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2134692-A2 | QUINOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM FOR SELECTIN INHIBITION | Wyeth a Corporation of the State of Delaware (US) | 2009-12-23 | — | — | EP | disclosed |
| WO-2008121817-A2 | QUINOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM FOR SELECTIN INHIBITION | WYETH (US) | 2008-10-09 | — | — | WO | disclosed |