Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 4/20 | 0.55 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.51 |
| ▸ | CRHBP | P24387 | 1/20 | 0.50 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8910888 | 0.84 | CYP1A1 (0.56) | CYP1A1CYP1B1MAPTALDH1A1KMT2A | |
| SCHEMBL14518617 | 0.83 | CYP1A1 (0.61) | CYP1A1CYP1B1MAPTALDH1A1KMT2A | |
| SCHEMBL7862304 | 0.83 | CYP1A1 (0.61) | CYP1A1CYP1B1MAPTALDH1A1KMT2A | |
| SCHEMBL6805246 | 0.81 | CYP1A1 (0.42) | CYP1A1CYP1B1MAPTALDH1A1KMT2A | |
| SCHEMBL11270049 | 0.80 | CYP1A1 (0.53) | CYP1A1CYP1B1MAPTALDH1A1KMT2A | |
| SCHEMBL1480652 | 0.80 | CYP1A1 (0.53) | CYP1A1CYP1B1MAPTALDH1A1KMT2A | |
| SCHEMBL1546324 | 0.80 | NFE2L2 (0.59) | CYP1A1CYP1B1MAPTCYP19A1CYP1A2 | |
| SCHEMBL1480651 | 0.80 | CYP1A1 (0.53) | CYP1A1CYP1B1MAPTALDH1A1KMT2A | |
| SCHEMBL31474876 | 0.80 | ALDH1A1 (0.56) | CYP1A1CYP1B1MAPTALDH1A1KMT2A | |
| SCHEMBL269268 | 0.80 | ALDH1A1 (0.56) | CYP1A1CYP1B1MAPTALDH1A1KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5622953-A | DRUG RESISTANT TO ANTICANCER CHEMOTHERAPEUTIC DRUG | BASF AKTIENGESELLSCHAFT (DE) | 1997-04-22 | — | — | US | disclosed |
| EP-0691962-A1 | 1-AMINO-3-PHENOXY PROPANE DERIVATIVES AS MODULATORS OF MULTI-DRUG RESISTANCE | BASF AKTIENGESELLSCHAFT (DE) | 1996-01-17 | — | — | EP | disclosed |
| WO-1994022842-A1 | 1-AMINO-3-PHENOXY PROPANE DERIVATIVES AS MODULATORS OF MULTI-DRUG RESISTANCE | BASF AKTIENGESELLSCHAFT (DE) | 1994-10-13 | — | — | WO | disclosed |
| US-4873349-A | Ruthenium catalyst for biarylic coupling; new steganolides | UNIVERSITE DU MAINE (LE MANS) (FR) | 1989-10-10 | — | — | US | disclosed |