Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.42 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | GPR52 | Q9Y2T5 | 5/20 | 0.41 |
| ▸ | CYP4F2 | P78329 | 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 | |
|---|---|---|---|---|
| SCHEMBL8499393 | 1.00 | ALDH1A1 (0.50) | ALDH1A1HPGDHSD17B10CA2CAMK2A | |
| SCHEMBL5085202 | 0.78 | GPR52 (0.47) | GPR52 | |
| SCHEMBL23188649 | 0.77 | CYP1A2 (0.43) | GPR52 | |
| SCHEMBL31422448 | 0.76 | PTGS1 (0.47) | ALDH1A1HPGDHSD17B10CA2CAMK2A | |
| SCHEMBL755404 | 0.75 | TAAR1 (0.42) | ALDH1A1KDM4EPOLBPTGS1 | |
| SCHEMBL755405 | 0.75 | TAAR1 (0.42) | ALDH1A1KDM4EPOLBPTGS1 | |
| SCHEMBL8503304 | 0.74 | ALDH1A1 (0.55) | ALDH1A1HPGDHSD17B10CA2CAMK2A | |
| SCHEMBL9089148 | 0.74 | CYP4A11 (0.41) | ALDH1A1HPGDHSD17B10CA2GPR52 | |
| SCHEMBL9089152 | 0.74 | CYP4A11 (0.41) | ALDH1A1HPGDHSD17B10CA2GPR52 | |
| SCHEMBL2996429 | 0.73 | CA2 (0.68) | ALDH1A1HPGDHSD17B10CA2CAMK2A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5892034-A | Process for preparing 5-substituted pyrrolo- 2,3-d!pyrimidines | ELI LILLY AND COMPANY (US) | 1999-04-06 | — | — | US | disclosed |
| US-5663339-A | Process for preparing 5-substituted pyrrolo-[2,3-D] pyrimidines | ELI LILLY AND COMPANY (US) | 1997-09-02 | — | — | US | disclosed |
| US-5644058-A | Process for preparing 5-substituted pyrrolo-[2,3-d]pyrimidines | ELI LILLY AND COMPANY (US) | 1997-07-01 | — | — | US | disclosed |
| US-5612482-A | Process for preparing 5-substituted pyrrolo-[2,3-d]pyrimidines | ELI LILLY AND COMPANY (US) | 1997-03-18 | — | — | US | disclosed |
| US-5416211-A | Process for preparing 5-substituted pyrrolo-[2,3-d]pyrimidines | ELI LILLY AND COMPANY (US) | 1995-05-16 | — | — | US | disclosed |
| EP-0589720-A2 | Process for preparing 5-substituted pyrrolo-[2,3-d]pyrimidines | ELI LILLY AND COMPANY (US) | 1994-03-30 | — | — | EP | disclosed |