Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | IGFBP3 | P17936 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.40 |
| ▸ | FEN1 | P39748 | 1/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL9460267 | 0.76 | LMNA (0.51) | ALDH1A1TSHRNPC1RAB9AKMT2A | |
| SCHEMBL31673611 | 0.76 | KMT2A (0.47) | ALDH1A1KMT2A | |
| SCHEMBL461125 | 0.76 | KMT2A (0.47) | ALDH1A1KMT2A | |
| SCHEMBL2805806 | 0.75 | L3MBTL1 (0.41) | ALDH1A1TSHRKDM4ESMN1; SMN2 | |
| SCHEMBL6915594 | 0.73 | ALDH1A1 (0.95) | ALDH1A1CES2CES1POLBTSHR | |
| SCHEMBL20239533 | 0.73 | POLB (0.45) | ALDH1A1POLBTSHRNPC1RAB9A | |
| SCHEMBL9166777 | 0.72 | ALDH1A1 (0.62) | ALDH1A1CES2CES1IGFBP3TSHR | |
| SCHEMBL31304680 | 0.71 | ALDH1A1 (0.75) | ALDH1A1CES2CES1POLBTSHR | |
| SCHEMBL5151518 | 0.71 | ALDH1A1 (0.75) | ALDH1A1CES2CES1POLBTSHR | |
| SCHEMBL11362364 | 0.71 | ALDH1A1 (0.53) | ALDH1A1KMT2AFEN1TP53KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0230110-A1 | Pharmacologically active pyrrole and pyrazole derivatives | FISONS plc (GB) | 1987-07-29 | — | — | EP | claimed |