Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL6950609 | 0.89 | PKM (0.71) | CHRM1CYP1A2CYP2C9POLBRAB9A | |
| SCHEMBL711507 | 0.84 | PKM (0.71) | CYP1A2CYP2C9POLBRAB9APKM | |
| SCHEMBL31734838 | 0.84 | PKM (0.71) | CYP1A2CYP2C9POLBRAB9APKM | |
| Hydrochloric Acid SCHEMBL710492 | 0.81 | PKM (0.67) | CYP1A2CYP2C9POLBRAB9APKM | |
| Hydrochloric Acid SCHEMBL710491 | 0.81 | PKM (0.72) | CYP1A2CYP2C9POLBRAB9APKM | |
| SCHEMBL12200972 | 0.80 | GAA (0.65) | CHRM1CYP1A2CYP2C9POLBRAB9A | |
| SCHEMBL305355 | 0.79 | POLB (0.64) | CHRM1POLBRAB9APKMKMT2A | |
| SCHEMBL8508703 | 0.79 | CHRM1 (0.61) | CHRM1CYP1A2CYP2C9POLBRAB9A | |
| SCHEMBL370673 | 0.78 | PKM (0.67) | CYP1A2CYP2C9POLBRAB9APKM | |
| Hydrochloric Acid SCHEMBL27826900 | 0.78 | POLB (0.63) | CHRM1POLBRAB9APKMKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0869787-A4 | VITRONECTIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 1999-03-24 | — | — | EP | disclosed |
| EP-0869787-A1 | VITRONECTIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1998-10-14 | — | — | EP | disclosed |
| WO-1997024119-A1 | VITRONECTIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1997-07-10 | — | — | WO | disclosed |