Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | AHR | P35869 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5320628 | 0.85 | TSHR (0.54) | TSHRRAB9ASMN1; SMN2ATMMEN1 | |
| SCHEMBL591099 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL6072699 | 0.79 | — | — | |
| SCHEMBL1127485 | 0.79 | TSHR (0.53) | TSHRRAB9ASMN1; SMN2ATMCYP1A2 | |
| SCHEMBL27859708 | 0.79 | — | — | |
| SCHEMBL27410499 | 0.77 | TSHR (0.47) | TSHRRAB9ASMN1; SMN2ATMMEN1 | |
| SCHEMBL29137674 | 0.77 | TSHR (0.47) | TSHRRAB9ASMN1; SMN2NPC1CYP1A2 | |
| SCHEMBL1126578 | 0.77 | TSHR (0.47) | TSHRRAB9ASMN1; SMN2ATMMEN1 | |
| SCHEMBL5644394 | 0.75 | — | — | |
| SCHEMBL371069 | 0.75 | TSHR (0.54) | TSHRRAB9ASMN1; SMN2ATMMEN1 |
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-4243672-A | CARDIOVASCULAR DISORDERS; CARDIOTONIC AGENTS | PFIZER INC. (US) | 1981-01-06 | — | — | US | disclosed |
| EP-0009326-A2 | Pyrrolyl keto and amino acids and derivatives thereof, processes for their preparation and pharmaceutical compositions containing them | Pfizer Limited (GB) | 1980-04-02 | — | — | EP | disclosed |