Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.40 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 1/20 | 0.40 |
| ▸ | CCND1 | P24385 | 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 | |
|---|---|---|---|---|
| SCHEMBL2123689 | 0.74 | ROCK1 (0.49) | ROCK1LMNATP53MAPK1SMN1; SMN2 | |
| SCHEMBL11883161 | 0.74 | EED (0.46) | TSHRCYP1A2 | |
| SCHEMBL9562173 | 0.71 | TP53 (0.44) | ROCK1LMNATP53MAPK1SMN1; SMN2 | |
| SCHEMBL10620614 | 0.71 | MEN1 (0.51) | LMNACYP1A2ALDH1A1ALOX15MEN1 | |
| SCHEMBL3239758 | 0.70 | ROCK1 (0.61) | ROCK1LMNATP53MAPK1SMN1; SMN2 | |
| SCHEMBL29721693 | 0.70 | ROCK1 (0.61) | ROCK1LMNATP53MAPK1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8675065 | 0.69 | CYP1A2 (0.65) | TSHRCYP1A2ALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL27693256 | 0.69 | ROCK1 (0.59) | ROCK1LMNATP53MAPK1SMN1; SMN2 | |
| SCHEMBL6071629 | 0.68 | ROCK1 (0.62) | ROCK1LMNATP53MAPK1SMN1; SMN2 | |
| SCHEMBL29721478 | 0.68 | ROCK1 (0.62) | ROCK1LMNATP53MAPK1SMN1; SMN2 |
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-3935199-A | ANALEPTIC | MEAD JOHNSON & COMPANY (US) | 1976-01-27 | — | — | US | claimed |
| US-5017584-A | Antidepressant 2-(4,5-dihydro-1H-imidazolyl)-dihydro-1H-indoles, -1,2,3,4-tetrahydroquinolines and -1H-indoles, and methods of use thereas | STERLING DRUG INC. (US) | 1991-05-21 | — | — | US | disclosed |