Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8988234 | 0.90 | HSP90AA1 (0.46) | HSP90AA1KDM4EALDH1A1KMT2ANPC1 | |
| SCHEMBL11657276 | 0.90 | POLB (0.46) | HSP90AA1KDM4EKMT2AGRIN2BSMN1; SMN2 | |
| SCHEMBL6375003 | 0.89 | GRIN2B (0.55) | HSP90AA1KDM4EALDH1A1KMT2ANPC1 | |
| Hydrochloric Acid SCHEMBL8655604 | 0.89 | HSP90AA1 (0.45) | HSP90AA1KDM4EALDH1A1KMT2ANPC1 | |
| Hydrochloric Acid SCHEMBL11654776 | 0.80 | ALOX15 (0.46) | KDM4EALDH1A1KMT2AGRIN2BL3MBTL1 | |
| Hydrochloric Acid SCHEMBL9360470 | 0.80 | POLB (0.44) | HSP90AA1KDM4EKMT2AGRIN2BSMN1; SMN2 | |
| SCHEMBL8706167 | 0.79 | ALDH1A1 (0.42) | HSP90AA1KDM4EALDH1A1KMT2ANPC1 | |
| SCHEMBL7304554 | 0.79 | ALDH1A1 (0.42) | HSP90AA1KDM4EALDH1A1KMT2ANPC1 | |
| SCHEMBL6373808 | 0.75 | KMT2A (0.53) | KDM4EALDH1A1KMT2ANPC1RAB9A | |
| SCHEMBL11623381 | 0.75 | RAB9A (0.50) | HSP90AA1KDM4EALDH1A1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-4074049-A | Antithrombotic 1,3,4-thiadiazole | THE DOW CHEMICAL COMPANY (US) | 1978-02-14 | — | — | US | claimed |
| US-4074049-A | Antithrombotic 1,3,4-thiadiazole | THE DOW CHEMICAL COMPANY (US) | 1978-02-14 | — | — | US | disclosed |