Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.36 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3639673 | 0.87 | TSHR (0.50) | TSHRTDP1KMT2AALDH1A1VCAM1 | |
| SCHEMBL9078790 | 0.85 | TSHR (0.44) | TSHRTDP1KMT2AALDH1A1VCAM1 | |
| SCHEMBL28226522 | 0.82 | ALDH1A1 (0.41) | TSHRTDP1KMT2AALDH1A1CYP1A2 | |
| SCHEMBL27935928 | 0.79 | KMT2A (0.39) | TSHRTDP1KMT2AALDH1A1VCAM1 | |
| SCHEMBL3343211 | 0.79 | KMT2A (0.39) | TSHRTDP1KMT2AALDH1A1VCAM1 | |
| SCHEMBL4833152 | 0.78 | ALDH1A1 (0.45) | TSHRTDP1KMT2AALDH1A1GRIN2D | |
| SCHEMBL10558557 | 0.78 | TSHR (0.64) | TSHRKMT2AALDH1A1VCAM1CYP1A2 | |
| SCHEMBL31441001 | 0.78 | ALDH1A1 (0.45) | TSHRTDP1KMT2AALDH1A1GRIN2D | |
| SCHEMBL10980919 | 0.78 | TSHR (0.62) | TSHRTDP1ALDH1A1VCAM1HSD17B10 | |
| SCHEMBL28165913 | 0.77 | ALDH1A1 (0.43) | TSHRKMT2AALDH1A1VCAM1CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6403578-B1 | ANTICOAGULANTS, CARDIOVASCULAR DISORDERS | SMITHKLINE BEECHAM CORPORATION | 2002-06-11 | — | — | US | disclosed |
| 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 |