Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | RARA | P10276 | 1/20 | 0.43 |
| ▸ | RARB | P10826 | 1/20 | 0.43 |
| ▸ | RARG | P13631 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.39 |
| ▸ | PRKCI | P41743 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8339527 | 0.89 | POLB (0.45) | ALDH1A1POLBNPC1SMN1; SMN2HPGD | |
| SCHEMBL5119506 | 0.80 | PRKCI (0.57) | ALDH1A1POLBNPC1SMN1; SMN2HPGD | |
| SCHEMBL8339222 | 0.78 | KDM4E (0.46) | ALDH1A1POLBNPC1SMN1; SMN2HPGD | |
| SCHEMBL8334672 | 0.76 | RARA (0.41) | ALDH1A1POLBNPC1SMN1; SMN2HPGD | |
| SCHEMBL8170324 | 0.75 | ALDH1A1 (0.49) | ALDH1A1POLBNPC1SMN1; SMN2HPGD | |
| SCHEMBL8180806 | 0.75 | FYN (0.46) | ALDH1A1NPC1SMN1; SMN2KDM4EGFER | |
| SCHEMBL8183517 | 0.75 | PRKCI (0.50) | ALDH1A1SMN1; SMN2HPGDRARARARB | |
| SCHEMBL8336745 | 0.74 | ABCC1 (0.55) | ALDH1A1POLBNPC1SMN1; SMN2HPGD | |
| SCHEMBL8171294 | 0.74 | PRKCI (0.53) | ALDH1A1SMN1; SMN2KDM4EHTTPRKCI | |
| SCHEMBL8184718 | 0.74 | FLT3 (0.51) | ALDH1A1SMN1; SMN2HPGDKDM4EFLT3 |
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-5948911-A | Method for inhibiting neoplastic cells and related conditions by exposure to thienopyrimidine derivatives | CELL PATHWAYS, INC. (US) | 1999-09-07 | — | — | US | disclosed |