Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.55 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.49 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30445111 | 0.80 | ALDH1A1 (0.65) | ALDH1A1TDP1CYP3A4TSHRKMT2A | |
| SCHEMBL5518772 | 0.80 | ALDH1A1 (0.60) | ALDH1A1TDP1CYP3A4TSHRKMT2A | |
| SCHEMBL7566531 | 0.80 | ALDH1A1 (0.65) | ALDH1A1TDP1CYP3A4TSHRKMT2A | |
| SCHEMBL4402292 | 0.80 | TSHR (0.61) | ALDH1A1CYP3A4TSHRKMT2APOLB | |
| SCHEMBL16957612 | 0.80 | ALDH1A1 (0.59) | ALDH1A1TDP1CYP3A4TSHRKMT2A | |
| SCHEMBL3824914 | 0.80 | ALDH1A1 (0.63) | ALDH1A1TDP1CYP3A4TSHRKMT2A | |
| SCHEMBL2156946 | 0.80 | ALDH1A1 (0.63) | ALDH1A1TDP1CYP3A4TSHRKMT2A | |
| SCHEMBL5607423 | 0.79 | MAPT (0.45) | ALDH1A1TDP1CYP3A4TSHRKMT2A | |
| SCHEMBL2678636 | 0.79 | KMT2A (0.48) | ALDH1A1KMT2APOLBMEN1MAPT | |
| SCHEMBL176357 | 0.78 | TTR (0.68) | ALDH1A1TDP1CYP3A4TSHRKMT2A |
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-1959951-B1 | HETEROARYL SUBSTITUTED PIPERIDINE DERIVATIVES AS L-CPT1 INHIBITORS | HOFFMANN LA ROCHE (CH) | 2009-12-23 | — | — | EP | disclosed |