Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 9/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | THRA | P10827 | 3/20 | 0.44 |
| ▸ | VDR | P11473 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6945929 | 0.83 | ALDH1A1 (0.51) | THRBMAPTHTTLMNANTSR1 | |
| SCHEMBL6378072 | 0.81 | ALDH1A1 (0.51) | THRBMAPTHTTLMNANTSR1 | |
| Phenethylamine SCHEMBL7549970 | 0.80 | THRB (0.58) | THRBMAPTHTTLMNANTSR1 | |
| SCHEMBL27417336 | 0.71 | ALDH1A1 (0.49) | THRBMAPTHTTLMNANTSR1 | |
| SCHEMBL6952927 | 0.71 | ALDH1A1 (0.47) | THRBMAPTHTTLMNANTSR1 | |
| SCHEMBL11247732 | 0.70 | CASP6 (0.57) | MAPTNPC1RAB9AVCAM1KMT2A | |
| SCHEMBL4025027 | 0.70 | KMT2A (0.50) | MAPTNPC1RAB9AKMT2AALDH1A1 | |
| SCHEMBL6656269 | 0.70 | SLC7A5 (0.45) | MAPTHTTLMNANPC1RAB9A | |
| SCHEMBL6378052 | 0.69 | ALDH1A1 (0.47) | THRBMAPTHTTLMNANTSR1 | |
| SCHEMBL27417335 | 0.69 | NPC1 (0.47) | THRBMAPTHTTLMNANTSR1 |
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-0674623-A1 | BICYCLIC FIBRINOGEN ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1995-10-04 | — | — | EP | disclosed |
| WO-1994014776-A2 | BICYCLIC FIBRINOGEN ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1994-07-07 | — | — | WO | disclosed |